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

Systemtic Name: 1-(4-ethylpiperazin-1-yl)-2-[3-[(2-methylphenyl)methylsulfonyl]indol-1-yl]ethanone Openeye Name: 1-(4-ethylpiperazin-1-yl)-2-[3-(o-tolylmethylsulfonyl)indol-1-yl]ethanone CAS Name: 1-(4-ethyl-1-piperazinyl)-2-[3-[(2-methylphenyl)methylsulfonyl]-1-indolyl]ethanone IUPAC Name: 1-(4-ethylpiperazin-1-yl)-2-[3-[(2-methylphenyl)methylsulfonyl]indol-1-yl]ethanone Traditional Name: 1-(4-ethylpiperazino)-2-[3-(2-methylbenzyl)sulfonylindol-1-yl]ethanone Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)CN2C=C(C3=CC=CC=C32)S(=O)(=O)CC4=CC=CC=C4C

Isomeric SMILES

CCN1CCN(CC1)C(=O)CN2C=C(C3=CC=CC=C32)S(=O)(=O)CC4=CC=CC=C4C

InChI

InChI=1S/C24H29N3O3S/c1-3-25-12-14-26(15-13-25)24(28)17-27-16-23(21-10-6-7-11-22(21)27)31(29,30)18-20-9-5-4-8-19(20)2/h4-11,16H,3,12-15,17-18H2,1-2H3