2-[4-(3-methylphenyl)-3-(phenylsulfanylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]-N-phenyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-(3-methylphenyl)-3-(phenylsulfanylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]-N-phenyl-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[4-(m-tolyl)-3-(phenylsulfanylmethyl)-5-thioxo-1,2,4-triazol-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-(3-methylphenyl)-3-[(phenylthio)methyl]-5-sulfanylidene-1,2,4-triazol-1-yl]-N-phenyl-N-propan-2-ylacetamide IUPAC Name: 2-[4-(3-methylphenyl)-3-(phenylsulfanylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]-N-phenyl-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[4-(m-tolyl)-3-[(phenylthio)methyl]-5-thioxo-1,2,4-triazol-1-yl]-N-phenyl-acetamide Formula: C27H28N4OS2 MolecularWeight: 488.66742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN(C2=S)CC(=O)N(C3=CC=CC=C3)C(C)C)CSC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN(C2=S)CC(=O)N(C3=CC=CC=C3)C(C)C)CSC4=CC=CC=C4

InChI

InChI=1S/C27H28N4OS2/c1-20(2)30(22-12-6-4-7-13-22)26(32)18-29-27(33)31(23-14-10-11-21(3)17-23)25(28-29)19-34-24-15-8-5-9-16-24/h4-17,20H,18-19H2,1-3H3