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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SCC(=O)N(C3=CC=CC=C3)C(C)C)CSC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SCC(=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)19-34-27-29-28-25(18-33-24-15-8-5-9-16-24)31(27)23-14-10-11-21(3)17-23/h4-17,20H,18-19H2,1-3H3