N-[2-[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]ethyl]-2-phenyl-ethanamide

Systemtic Name: N-[2-[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]ethyl]-2-phenyl-ethanamide Openeye Name: N-[2-[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]ethyl]-2-phenyl-acetamide CAS Name: N-[2-[4-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]ethyl]-2-phenylacetamide IUPAC Name: N-[2-[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]ethyl]-2-phenylacetamide Traditional Name: N-[2-[4-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]ethyl]-2-phenyl-acetamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=C2SC)CCNC(=O)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SC)CCNC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O2S/c1-26-17-10-8-16(9-11-17)24-18(22-23-20(24)27-2)12-13-21-19(25)14-15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3,(H,21,25)