2-phenylsulfanyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]pyridine-3-carboxamide

Systemtic Name: 2-phenylsulfanyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]pyridine-3-carboxamide Openeye Name: 2-phenylsulfanyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]pyridine-3-carboxamide CAS Name: 2-(phenylthio)-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]-3-pyridinecarboxamide IUPAC Name: 2-phenylsulfanyl-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]pyridine-3-carboxamide Traditional Name: 2-(phenylthio)-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]nicotinamide Formula: C22H19N5OS MolecularWeight: 401.48416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=NC=N2)NC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=NC=N2)NC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C22H19N5OS/c1-16(17-9-11-18(12-10-17)27-15-23-14-25-27)26-21(28)20-8-5-13-24-22(20)29-19-6-3-2-4-7-19/h2-16H,1H3,(H,26,28)