2-[methyl(methylsulfonyl)amino]-N-[(2S)-1-oxidanyl-3-thiophen-3-yl-propan-2-yl]-6-(3-phenylpyrrolidin-1-yl)pyridine-4-carboxamide

Systemtic Name: 2-[methyl(methylsulfonyl)amino]-N-[(2S)-1-oxidanyl-3-thiophen-3-yl-propan-2-yl]-6-(3-phenylpyrrolidin-1-yl)pyridine-4-carboxamide Openeye Name: N-[(1S)-1-(hydroxymethyl)-2-(3-thienyl)ethyl]-2-[methyl(methylsulfonyl)amino]-6-(3-phenylpyrrolidin-1-yl)pyridine-4-carboxamide CAS Name: N-[(2S)-1-hydroxy-3-(3-thiophenyl)propan-2-yl]-2-[methyl(methylsulfonyl)amino]-6-(3-phenyl-1-pyrrolidinyl)-4-pyridinecarboxamide IUPAC Name: N-[(2S)-1-hydroxy-3-thiophen-3-ylpropan-2-yl]-2-[methyl(methylsulfonyl)amino]-6-(3-phenylpyrrolidin-1-yl)pyridine-4-carboxamide Traditional Name: 2-[mesyl(methyl)amino]-N-[(1S)-1-methylol-2-(3-thienyl)ethyl]-6-(3-phenylpyrrolidino)isonicotinamide Formula: C25H30N4O4S2 MolecularWeight: 514.6601

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC(=CC(=N1)N2CCC(C2)C3=CC=CC=C3)C(=O)NC(CC4=CSC=C4)CO)S(=O)(=O)C

Isomeric SMILES

CN(C1=CC(=CC(=N1)N2CCC(C2)C3=CC=CC=C3)C(=O)N[C@@H](CC4=CSC=C4)CO)S(=O)(=O)C

InChI

InChI=1S/C25H30N4O4S2/c1-28(35(2,32)33)23-13-21(25(31)26-22(16-30)12-18-9-11-34-17-18)14-24(27-23)29-10-8-20(15-29)19-6-4-3-5-7-19/h3-7,9,11,13-14,17,20,22,30H,8,10,12,15-16H2,1-2H3,(H,26,31)/t20?,22-/m0/s1