2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(pyridin-4-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(pyridin-4-ylmethyl)phenyl]ethanamide Openeye Name: 2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(4-pyridylmethyl)phenyl]acetamide CAS Name: 2-[(1-phenyl-1,2,4-triazol-3-yl)thio]-N-[4-(pyridin-4-ylmethyl)phenyl]acetamide IUPAC Name: 2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(pyridin-4-ylmethyl)phenyl]acetamide Traditional Name: 2-[(1-phenyl-1,2,4-triazol-3-yl)thio]-N-[4-(4-pyridylmethyl)phenyl]acetamide Formula: C22H19N5OS MolecularWeight: 401.48416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=NC(=N2)SCC(=O)NC3=CC=C(C=C3)CC4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C=NC(=N2)SCC(=O)NC3=CC=C(C=C3)CC4=CC=NC=C4

InChI

InChI=1S/C22H19N5OS/c28-21(15-29-22-24-16-27(26-22)20-4-2-1-3-5-20)25-19-8-6-17(7-9-19)14-18-10-12-23-13-11-18/h1-13,16H,14-15H2,(H,25,28)