2-[3-(4-methylphenyl)sulfonylindol-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[3-(4-methylphenyl)sulfonylindol-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[3-(p-tolylsulfonyl)indol-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[3-(4-methylphenyl)sulfonyl-1-indolyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[3-(4-methylphenyl)sulfonylindol-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 1-pyrrolidino-2-(3-tosylindol-1-yl)ethanone Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCCC4

InChI

InChI=1S/C21H22N2O3S/c1-16-8-10-17(11-9-16)27(25,26)20-14-23(19-7-3-2-6-18(19)20)15-21(24)22-12-4-5-13-22/h2-3,6-11,14H,4-5,12-13,15H2,1H3