N-(4-cyclopentylsulfanylphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide

Systemtic Name: N-(4-cyclopentylsulfanylphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide Openeye Name: N-(4-cyclopentylsulfanylphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide CAS Name: N-[4-(cyclopentylthio)phenyl]-2-(1,2,4-triazol-1-yl)-4-pyridinecarboxamide IUPAC Name: N-(4-cyclopentylsulfanylphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide Traditional Name: N-[4-(cyclopentylthio)phenyl]-2-(1,2,4-triazol-1-yl)isonicotinamide Formula: C19H19N5OS MolecularWeight: 365.45206

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=CC=C(C=C2)NC(=O)C3=CC(=NC=C3)N4C=NC=N4

Isomeric SMILES

C1CCC(C1)SC2=CC=C(C=C2)NC(=O)C3=CC(=NC=C3)N4C=NC=N4

InChI

InChI=1S/C19H19N5OS/c25-19(14-9-10-21-18(11-14)24-13-20-12-22-24)23-15-5-7-17(8-6-15)26-16-3-1-2-4-16/h5-13,16H,1-4H2,(H,23,25)