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Home> Hot Product Listed M   > MOLPORT-001-823-812
864925-46-2 structure

MOLPORT-001-823-812

Iupac Name:N-(4-ethoxy-3-ethyl-1,3-benzothiazol-2-ylidene)-1,3-benzothiazole-2-carboxamide
CAS No.:864925-46-2
Molecular Weight:383.484
Molecular Formula:C14H10F2N2O2 (isomer)
Names and Identifiers
Synonyms

(((3,4-dichloroanilino)carbonyl)hydrazono)(4-pyridinyl)methanol ((3,4-dichlorophenyl)amino)-n-(4-pyridylcarbonylamino)formamide [(3,4-dichlorophenyl)amino]-n-(4-pyridylcarbonylamino)carboxamide 1-(3,4-dichlorophenyl)-3-(pyridine-4-carbonylamino)urea 304883-43-0 AC1MRKGL AKOS003629233 BG01847507 BG02131295 KS-000029L4 MCULE-1504249770 mfcd00416713 MS-8546 n-(3,4-dichlorophenyl)-2-(pyridin-4-ylcarbonyl)hydrazinecarboxamide n-{[(3,4-dichlorophenyl)carbamoyl]amino}pyridine-4-carboxamide n-{[(e)-(3,4-dichlorophenyl)-c-hydroxycarbonimidoyl]amino}pyridine-4-carboxamide sr-01000408286 SR-01000408286-1 ST50953062 STL267166 ZINC5670499

Inchi
InChI=1S/C19H17N3O2S2/c1-3-22-16-13(24-4-2)9-7-11-15(16)26-19(22)21-17(23)18-20-12-8-5-6-10-14(12)25-18/h5-11H,3-4H2,1-2H3
InChkey
YZIPICRUSPRYJF-UHFFFAOYSA-N
Canonical Smiles
CCN1C2=C(C=CC=C2SC1=NC(=O)C3=NC4=CC=CC=C4S3)OCC
Computational chemical data
  • Molecular Weight:383.484g/mol
  • Molecular Formula:C14H10F2N2O2
  • Compound Is Canonicalized:True
  • Exact Mass:383.076
  • Monoisotopic Mass:383.076
  • Complexity:559
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:5
  • Heavy Atom Count:26
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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