2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone

Systemtic Name: 2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone Openeye Name: 1-(2-methylindolin-1-yl)-2-[4-(4-sec-butylphenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone IUPAC Name: 2-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone Traditional Name: 1-(2-methylindolin-1-yl)-2-[4-(4-sec-butylphenyl)sulfonylpiperazino]ethanone Formula: C25H33N3O3S MolecularWeight: 455.61282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)N3C(CC4=CC=CC=C43)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)N3C(CC4=CC=CC=C43)C

InChI

InChI=1S/C25H33N3O3S/c1-4-19(2)21-9-11-23(12-10-21)32(30,31)27-15-13-26(14-16-27)18-25(29)28-20(3)17-22-7-5-6-8-24(22)28/h5-12,19-20H,4,13-18H2,1-3H3