2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(2-phenyl-1H-indol-3-yl)ethanone

Systemtic Name: 2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(2-phenyl-1H-indol-3-yl)ethanone Openeye Name: 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2-phenyl-1H-indol-3-yl)ethanone CAS Name: 2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-1-(2-phenyl-1H-indol-3-yl)ethanone IUPAC Name: 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2-phenyl-1H-indol-3-yl)ethanone Traditional Name: 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)thio]-1-(2-phenyl-1H-indol-3-yl)ethanone Formula: C26H22N4OS MolecularWeight: 438.54408

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)C2=C(NC3=CC=CC=C32)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CN1C(=NN=C1SCC(=O)C2=C(NC3=CC=CC=C32)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C26H22N4OS/c1-30-23(16-18-10-4-2-5-11-18)28-29-26(30)32-17-22(31)24-20-14-8-9-15-21(20)27-25(24)19-12-6-3-7-13-19/h2-15,27H,16-17H2,1H3