1-[4-[4-[(3-methylphenyl)methyl]piperazin-1-yl]sulfonylphenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[4-[(3-methylphenyl)methyl]piperazin-1-yl]sulfonylphenyl]pyrrolidin-2-one Openeye Name: 1-[4-[4-(m-tolylmethyl)piperazin-1-yl]sulfonylphenyl]pyrrolidin-2-one CAS Name: 1-[4-[[4-[(3-methylphenyl)methyl]-1-piperazinyl]sulfonyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[4-[(3-methylphenyl)methyl]piperazin-1-yl]sulfonylphenyl]pyrrolidin-2-one Traditional Name: 1-[4-[4-(3-methylbenzyl)piperazino]sulfonylphenyl]-2-pyrrolidone Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C22H27N3O3S/c1-18-4-2-5-19(16-18)17-23-12-14-24(15-13-23)29(27,28)21-9-7-20(8-10-21)25-11-3-6-22(25)26/h2,4-5,7-10,16H,3,6,11-15,17H2,1H3