2-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]-N-(phenylmethyl)ethanesulfonamide

Systemtic Name: 2-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxidanylidene-ethyl]amino]-N-(phenylmethyl)ethanesulfonamide Openeye Name: N-benzyl-2-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxo-ethyl]amino]ethanesulfonamide CAS Name: 2-[[2-[(2S)-2-cyano-1-pyrrolidinyl]-2-oxoethyl]amino]-N-(phenylmethyl)ethanesulfonamide IUPAC Name: N-benzyl-2-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]ethanesulfonamide Traditional Name: N-benzyl-2-[[2-[(2S)-2-cyanopyrrolidino]-2-keto-ethyl]amino]ethanesulfonamide Formula: C16H22N4O3S MolecularWeight: 350.43588

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CNCCS(=O)(=O)NCC2=CC=CC=C2)C#N

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CNCCS(=O)(=O)NCC2=CC=CC=C2)C#N

InChI

InChI=1S/C16H22N4O3S/c17-11-15-7-4-9-20(15)16(21)13-18-8-10-24(22,23)19-12-14-5-2-1-3-6-14/h1-3,5-6,15,18-19H,4,7-10,12-13H2/t15-/m0/s1