(3S)-N-[(2S)-1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-[(2S)-1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(benzenesulfonyl)-N-[(1S)-2-(cyclopentylamino)-1-methyl-2-oxo-ethyl]piperidine-3-carboxamide CAS Name: (3S)-1-(benzenesulfonyl)-N-[(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(benzenesulfonyl)-N-[(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl]piperidine-3-carboxamide Traditional Name: (3S)-1-besyl-N-[(1S)-2-(cyclopentylamino)-2-keto-1-methyl-ethyl]nipecotamide Formula: C20H29N3O4S MolecularWeight: 407.52696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1CCCC1)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H29N3O4S/c1-15(19(24)22-17-9-5-6-10-17)21-20(25)16-8-7-13-23(14-16)28(26,27)18-11-3-2-4-12-18/h2-4,11-12,15-17H,5-10,13-14H2,1H3,(H,21,25)(H,22,24)/t15-,16-/m0/s1