(2S)-N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[4-(4-methylpiperidino)sulfonylphenyl]-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCCN3C(=O)C4=CC=CS4

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)[C@@H]3CCCN3C(=O)C4=CC=CS4

InChI

InChI=1S/C22H27N3O4S2/c1-16-10-13-24(14-11-16)31(28,29)18-8-6-17(7-9-18)23-21(26)19-4-2-12-25(19)22(27)20-5-3-15-30-20/h3,5-9,15-16,19H,2,4,10-14H2,1H3,(H,23,26)/t19-/m0/s1