(2S)-4-(4-methoxyphenyl)carbonyl-1-methylsulfonyl-N-[(3S)-2-oxidanylidenepiperidin-3-yl]piperazine-2-carboxamide

Systemtic Name: (2S)-4-(4-methoxyphenyl)carbonyl-1-methylsulfonyl-N-[(3S)-2-oxidanylidenepiperidin-3-yl]piperazine-2-carboxamide Openeye Name: (2S)-4-(4-methoxybenzoyl)-1-methylsulfonyl-N-[(3S)-2-oxo-3-piperidyl]piperazine-2-carboxamide CAS Name: (2S)-4-[(4-methoxyphenyl)-oxomethyl]-1-methylsulfonyl-N-[(3S)-2-oxo-3-piperidinyl]-2-piperazinecarboxamide IUPAC Name: (2S)-4-(4-methoxybenzoyl)-1-methylsulfonyl-N-[(3S)-2-oxopiperidin-3-yl]piperazine-2-carboxamide Traditional Name: (2S)-N-[(3S)-2-keto-3-piperidyl]-1-mesyl-4-p-anisoyl-piperazine-2-carboxamide Formula: C19H26N4O6S MolecularWeight: 438.49794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CCN(C(C2)C(=O)NC3CCCNC3=O)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCN([C@@H](C2)C(=O)N[C@H]3CCCNC3=O)S(=O)(=O)C

InChI

InChI=1S/C19H26N4O6S/c1-29-14-7-5-13(6-8-14)19(26)22-10-11-23(30(2,27)28)16(12-22)18(25)21-15-4-3-9-20-17(15)24/h5-8,15-16H,3-4,9-12H2,1-2H3,(H,20,24)(H,21,25)/t15-,16-/m0/s1