N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(4-pyridylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(pyridin-4-ylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(pyridin-4-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(4-pyridylmethylthio)nicotinamide Formula: C19H13ClN4OS2 MolecularWeight: 412.91572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC2=CC=NC=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

C1=CC(=C(N=C1)SCC2=CC=NC=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C19H13ClN4OS2/c20-13-3-4-15-16(10-13)27-19(23-15)24-17(25)14-2-1-7-22-18(14)26-11-12-5-8-21-9-6-12/h1-10H,11H2,(H,23,24,25)