N-[2-(4-methylphenyl)sulfanylethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-[2-(p-tolylsulfanyl)ethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-[2-(p-tolylthio)ethyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C19H20N4OS MolecularWeight: 352.4533

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C19H20N4OS/c1-15-2-8-18(9-3-15)25-11-10-21-19(24)17-6-4-16(5-7-17)12-23-14-20-13-22-23/h2-9,13-14H,10-12H2,1H3,(H,21,24)