2-[(4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2,4-dimethylphenyl)ethanone

Systemtic Name: 2-[(4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2,4-dimethylphenyl)ethanone Openeye Name: 2-[(4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2,4-dimethylphenyl)ethanone CAS Name: 2-[[4-cyclopropyl-5-(3-indolylidene)-1H-1,2,4-triazol-3-yl]thio]-1-(2,4-dimethylphenyl)ethanone IUPAC Name: 2-[(4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2,4-dimethylphenyl)ethanone Traditional Name: 2-[(4-cyclopropyl-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl)thio]-1-(2,4-dimethylphenyl)ethanone Formula: C23H22N4OS MolecularWeight: 402.51198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)CSC2=NNC(=C3C=NC4=CC=CC=C43)N2C5CC5)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)CSC2=NNC(=C3C=NC4=CC=CC=C43)N2C5CC5)C

InChI

InChI=1S/C23H22N4OS/c1-14-7-10-17(15(2)11-14)21(28)13-29-23-26-25-22(27(23)16-8-9-16)19-12-24-20-6-4-3-5-18(19)20/h3-7,10-12,16,25H,8-9,13H2,1-2H3