(4-methylpiperazin-1-yl)-[5-methylsulfanyl-1-(4-propan-2-ylphenyl)sulfonyl-indol-2-yl]methanone

Systemtic Name: (4-methylpiperazin-1-yl)-[5-methylsulfanyl-1-(4-propan-2-ylphenyl)sulfonyl-indol-2-yl]methanone Openeye Name: [1-(4-isopropylphenyl)sulfonyl-5-methylsulfanyl-indol-2-yl]-(4-methylpiperazin-1-yl)methanone CAS Name: (4-methyl-1-piperazinyl)-[5-(methylthio)-1-(4-propan-2-ylphenyl)sulfonyl-2-indolyl]methanone IUPAC Name: (4-methylpiperazin-1-yl)-[5-methylsulfanyl-1-(4-propan-2-ylphenyl)sulfonylindol-2-yl]methanone Traditional Name: (4-methylpiperazino)-[5-(methylthio)-1-p-cumenylsulfonyl-indol-2-yl]methanone Formula: C24H29N3O3S2 MolecularWeight: 471.63536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)SC)C=C2C(=O)N4CCN(CC4)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)SC)C=C2C(=O)N4CCN(CC4)C

InChI

InChI=1S/C24H29N3O3S2/c1-17(2)18-5-8-21(9-6-18)32(29,30)27-22-10-7-20(31-4)15-19(22)16-23(27)24(28)26-13-11-25(3)12-14-26/h5-10,15-17H,11-14H2,1-4H3