2-[4-[(3S)-5-oxidanylidene-1-(phenylmethyl)pyrrolidin-3-yl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[(3S)-5-oxidanylidene-1-(phenylmethyl)pyrrolidin-3-yl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[(3S)-1-benzyl-5-oxo-pyrrolidine-3-carbonyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[oxo-[(3S)-5-oxo-1-(phenylmethyl)-3-pyrrolidinyl]methyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[(3S)-1-benzyl-5-oxopyrrolidine-3-carbonyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[(3S)-1-benzyl-5-keto-pyrrolidine-3-carbonyl]piperazino]sulfonylbenzonitrile Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2CC(=O)N(C2)CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCN1C(=O)[C@H]2CC(=O)N(C2)CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C23H24N4O4S/c24-15-19-8-4-5-9-21(19)32(30,31)27-12-10-25(11-13-27)23(29)20-14-22(28)26(17-20)16-18-6-2-1-3-7-18/h1-9,20H,10-14,16-17H2/t20-/m0/s1