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

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[2-(p-tolylsulfanyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[2-(p-tolylthio)ethyl]-4-(1,2,4-triazol-1-yl)benzamide Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)N3C=NC=N3

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C18H18N4OS/c1-14-2-8-17(9-3-14)24-11-10-20-18(23)15-4-6-16(7-5-15)22-13-19-12-21-22/h2-9,12-13H,10-11H2,1H3,(H,20,23)