4-[4-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[[4-[(2R)-2-(2-thienyl)pyrrolidine-1-carbonyl]-1-piperidyl]sulfonyl]benzonitrile CAS Name: 4-[[4-[oxo-[(2R)-2-thiophen-2-yl-1-pyrrolidinyl]methyl]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[(2R)-2-thiophen-2-ylpyrrolidine-1-carbonyl]piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[(2R)-2-(2-thienyl)pyrrolidine-1-carbonyl]piperidino]sulfonylbenzonitrile Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N)C4=CC=CS4

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N)C4=CC=CS4

InChI

InChI=1S/C21H23N3O3S2/c22-15-16-5-7-18(8-6-16)29(26,27)23-12-9-17(10-13-23)21(25)24-11-1-3-19(24)20-4-2-14-28-20/h2,4-8,14,17,19H,1,3,9-13H2/t19-/m1/s1