1-[4-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]sulfonylphenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]sulfonylphenyl]pyrrolidin-2-one Openeye Name: 1-[4-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]sulfonylphenyl]pyrrolidin-2-one CAS Name: 1-[4-[[(2R)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]sulfonyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]sulfonylphenyl]pyrrolidin-2-one Traditional Name: 1-[4-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]sulfonylphenyl]-2-pyrrolidone Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCCCCN2S(=O)(=O)C3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

CN1C=CC=C1[C@H]2CCCCCN2S(=O)(=O)C3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C21H27N3O3S/c1-22-14-5-8-19(22)20-7-3-2-4-16-24(20)28(26,27)18-12-10-17(11-13-18)23-15-6-9-21(23)25/h5,8,10-14,20H,2-4,6-7,9,15-16H2,1H3/t20-/m1/s1