2-[3-[(4-methylphenyl)methylsulfonyl]indol-1-yl]-1-(4-methylpiperazin-1-yl)ethanone

Systemtic Name: 2-[3-[(4-methylphenyl)methylsulfonyl]indol-1-yl]-1-(4-methylpiperazin-1-yl)ethanone Openeye Name: 1-(4-methylpiperazin-1-yl)-2-[3-(p-tolylmethylsulfonyl)indol-1-yl]ethanone CAS Name: 2-[3-[(4-methylphenyl)methylsulfonyl]-1-indolyl]-1-(4-methyl-1-piperazinyl)ethanone IUPAC Name: 2-[3-[(4-methylphenyl)methylsulfonyl]indol-1-yl]-1-(4-methylpiperazin-1-yl)ethanone Traditional Name: 2-[3-(4-methylbenzyl)sulfonylindol-1-yl]-1-(4-methylpiperazino)ethanone Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCN(CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCN(CC4)C

InChI

InChI=1S/C23H27N3O3S/c1-18-7-9-19(10-8-18)17-30(28,29)22-15-26(21-6-4-3-5-20(21)22)16-23(27)25-13-11-24(2)12-14-25/h3-10,15H,11-14,16-17H2,1-2H3