6-imidazol-1-yl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]pyridine-3-carboxamide

Systemtic Name: 6-imidazol-1-yl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]pyridine-3-carboxamide Openeye Name: 6-imidazol-1-yl-N-[4-(3-pyridylmethylsulfanyl)phenyl]pyridine-3-carboxamide CAS Name: 6-(1-imidazolyl)-N-[4-(3-pyridinylmethylthio)phenyl]-3-pyridinecarboxamide IUPAC Name: 6-imidazol-1-yl-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]pyridine-3-carboxamide Traditional Name: 6-imidazol-1-yl-N-[4-(3-pyridylmethylthio)phenyl]nicotinamide Formula: C21H17N5OS MolecularWeight: 387.45758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CSC2=CC=C(C=C2)NC(=O)C3=CN=C(C=C3)N4C=CN=C4

Isomeric SMILES

C1=CC(=CN=C1)CSC2=CC=C(C=C2)NC(=O)C3=CN=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C21H17N5OS/c27-21(17-3-8-20(24-13-17)26-11-10-23-15-26)25-18-4-6-19(7-5-18)28-14-16-2-1-9-22-12-16/h1-13,15H,14H2,(H,25,27)