2-[2-methyl-3-[1-(phenylmethyl)sulfonyl-3,6-dihydro-2H-pyridin-4-yl]indol-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[2-methyl-3-[1-(phenylmethyl)sulfonyl-3,6-dihydro-2H-pyridin-4-yl]indol-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[3-(1-benzylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-methyl-indol-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[2-methyl-3-[1-(phenylmethyl)sulfonyl-3,6-dihydro-2H-pyridin-4-yl]-1-indolyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[3-(1-benzylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-methylindol-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[3-(1-benzylsulfonyl-3,6-dihydro-2H-pyridin-4-yl)-2-methyl-indol-1-yl]-1-pyrrolidino-ethanone Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CC(=O)N3CCCC3)C4=CCN(CC4)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC(=O)N3CCCC3)C4=CCN(CC4)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C27H31N3O3S/c1-21-27(23-13-17-29(18-14-23)34(32,33)20-22-9-3-2-4-10-22)24-11-5-6-12-25(24)30(21)19-26(31)28-15-7-8-16-28/h2-6,9-13H,7-8,14-20H2,1H3