2-[3-(4-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[3-(4-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-phenethyl-ethanamide Openeye Name: 2-[3-(4-methoxyphenyl)-4-methyl-5-thioxo-1,2,4-triazol-1-yl]-N-phenethyl-acetamide CAS Name: 2-[3-(4-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-phenethylacetamide IUPAC Name: 2-[3-(4-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-phenethylacetamide Traditional Name: 2-[3-(4-methoxyphenyl)-4-methyl-5-thioxo-1,2,4-triazol-1-yl]-N-phenethyl-acetamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CC(=O)NCCC2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CN1C(=NN(C1=S)CC(=O)NCCC2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

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