(2S)-N-[4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]-1-methylsulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]-1-methylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[4-[[(3S,5S)-3,5-dimethyl-1-piperidyl]sulfonyl]phenyl]-1-methylsulfonyl-pyrrolidine-2-carboxamide CAS Name: (2S)-N-[4-[[(3S,5S)-3,5-dimethyl-1-piperidinyl]sulfonyl]phenyl]-1-methylsulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]-1-methylsulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-[4-[(3S,5S)-3,5-dimethylpiperidino]sulfonylphenyl]-1-mesyl-pyrrolidine-2-carboxamide Formula: C19H29N3O5S2 MolecularWeight: 443.58066

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCCN3S(=O)(=O)C)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)[C@@H]3CCCN3S(=O)(=O)C)C

InChI

InChI=1S/C19H29N3O5S2/c1-14-11-15(2)13-21(12-14)29(26,27)17-8-6-16(7-9-17)20-19(23)18-5-4-10-22(18)28(3,24)25/h6-9,14-15,18H,4-5,10-13H2,1-3H3,(H,20,23)/t14-,15-,18-/m0/s1