1-[2-methyl-1-(4-methylphenyl)-5-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]indol-3-yl]ethanone

Systemtic Name: 1-[2-methyl-1-(4-methylphenyl)-5-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]indol-3-yl]ethanone Openeye Name: 1-[2-methyl-5-[(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methoxy]-1-(p-tolyl)indol-3-yl]ethanone CAS Name: 1-[2-methyl-1-(4-methylphenyl)-5-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]-3-indolyl]ethanone IUPAC Name: 1-[2-methyl-1-(4-methylphenyl)-5-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]indol-3-yl]ethanone Traditional Name: 1-[2-methyl-5-[(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methoxy]-1-(p-tolyl)indol-3-yl]ethanone Formula: C27H24N4O2S MolecularWeight: 468.57006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C3=C2C=CC(=C3)OCC4=NNC(=S)N4C5=CC=CC=C5)C(=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C3=C2C=CC(=C3)OCC4=NNC(=S)N4C5=CC=CC=C5)C(=O)C)C

InChI

InChI=1S/C27H24N4O2S/c1-17-9-11-21(12-10-17)30-18(2)26(19(3)32)23-15-22(13-14-24(23)30)33-16-25-28-29-27(34)31(25)20-7-5-4-6-8-20/h4-15H,16H2,1-3H3,(H,29,34)