2-[3-[1-(3,4-dimethylphenyl)sulfonylpiperidin-4-yl]-2-methyl-indol-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[3-[1-(3,4-dimethylphenyl)sulfonylpiperidin-4-yl]-2-methyl-indol-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[3-[1-(3,4-dimethylphenyl)sulfonyl-4-piperidyl]-2-methyl-indol-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[3-[1-(3,4-dimethylphenyl)sulfonyl-4-piperidinyl]-2-methyl-1-indolyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[3-[1-(3,4-dimethylphenyl)sulfonylpiperidin-4-yl]-2-methylindol-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[3-[1-(3,4-dimethylphenyl)sulfonyl-4-piperidyl]-2-methyl-indol-1-yl]-1-pyrrolidino-ethanone Formula: C28H35N3O3S MolecularWeight: 493.6608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=C(N(C4=CC=CC=C43)CC(=O)N5CCCC5)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=C(N(C4=CC=CC=C43)CC(=O)N5CCCC5)C)C

InChI

InChI=1S/C28H35N3O3S/c1-20-10-11-24(18-21(20)2)35(33,34)30-16-12-23(13-17-30)28-22(3)31(26-9-5-4-8-25(26)28)19-27(32)29-14-6-7-15-29/h4-5,8-11,18,23H,6-7,12-17,19H2,1-3H3