(2S)-N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-(4-ethoxy-3-piperidinosulfonyl-phenyl)-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C23H29N3O5S2 MolecularWeight: 491.62346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2CCCN2C(=O)C3=CC=CS3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)[C@@H]2CCCN2C(=O)C3=CC=CS3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H29N3O5S2/c1-2-31-19-11-10-17(16-21(19)33(29,30)25-12-4-3-5-13-25)24-22(27)18-8-6-14-26(18)23(28)20-9-7-15-32-20/h7,9-11,15-16,18H,2-6,8,12-14H2,1H3,(H,24,27)/t18-/m0/s1