N-(3-acetamidophenyl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-(3-acetamidophenyl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-(3-acetamidophenyl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-(3-acetamidophenyl)-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-(3-acetamidophenyl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-(3-acetamidophenyl)-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C18H17N5O2S MolecularWeight: 367.42488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)CSC3=NC=NN3

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)CSC3=NC=NN3

InChI

InChI=1S/C18H17N5O2S/c1-12(24)21-15-3-2-4-16(9-15)22-17(25)14-7-5-13(6-8-14)10-26-18-19-11-20-23-18/h2-9,11H,10H2,1H3,(H,21,24)(H,22,25)(H,19,20,23)