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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)CN2C=C(C3=CC=CC=C32)S(=O)(=O)CC4=CC=C(C=C4)C

Isomeric SMILES

CCN1CCN(CC1)C(=O)CN2C=C(C3=CC=CC=C32)S(=O)(=O)CC4=CC=C(C=C4)C

InChI

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