N'-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonyl-2-chloranyl-pyridine-4-carbohydrazide

Systemtic Name: N'-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonyl-2-chloranyl-pyridine-4-carbohydrazide Openeye Name: N'-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]-2-chloro-pyridine-4-carbohydrazide CAS Name: N'-[[4-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-oxomethyl]-2-chloro-4-pyridinecarbohydrazide IUPAC Name: N'-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]-2-chloropyridine-4-carbohydrazide Traditional Name: N'-[4-[(1,3-benzothiazol-2-ylthio)methyl]benzoyl]-2-chloro-isonicotinohydrazide Formula: C21H15ClN4O2S2 MolecularWeight: 454.9524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC3=CC=C(C=C3)C(=O)NNC(=O)C4=CC(=NC=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC3=CC=C(C=C3)C(=O)NNC(=O)C4=CC(=NC=C4)Cl

InChI

InChI=1S/C21H15ClN4O2S2/c22-18-11-15(9-10-23-18)20(28)26-25-19(27)14-7-5-13(6-8-14)12-29-21-24-16-3-1-2-4-17(16)30-21/h1-11H,12H2,(H,25,27)(H,26,28)