1-(2-methyl-1H-indol-3-yl)-2-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propan-1-one

Systemtic Name: 1-(2-methyl-1H-indol-3-yl)-2-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propan-1-one Openeye Name: 1-(2-methyl-1H-indol-3-yl)-2-[[5-methyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propan-1-one CAS Name: 1-(2-methyl-1H-indol-3-yl)-2-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-1-propanone IUPAC Name: 1-(2-methyl-1H-indol-3-yl)-2-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propan-1-one Traditional Name: 1-(2-methyl-1H-indol-3-yl)-2-[[5-methyl-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]propan-1-one Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SC(C)C(=O)C3=C(NC4=CC=CC=C43)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SC(C)C(=O)C3=C(NC4=CC=CC=C43)C)C

InChI

InChI=1S/C22H22N4OS/c1-13-9-11-17(12-10-13)26-16(4)24-25-22(26)28-15(3)21(27)20-14(2)23-19-8-6-5-7-18(19)20/h5-12,15,23H,1-4H3