(2R,3S)-1-(4-methylphenyl)-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]-5-oxidanylidene-2-thiophen-2-yl-pyrrolidine-3-carboxamide

Systemtic Name: (2R,3S)-1-(4-methylphenyl)-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]-5-oxidanylidene-2-thiophen-2-yl-pyrrolidine-3-carboxamide Openeye Name: (2R,3S)-N-[(6-morpholino-3-pyridyl)methyl]-5-oxo-1-(p-tolyl)-2-(2-thienyl)pyrrolidine-3-carboxamide CAS Name: (2R,3S)-1-(4-methylphenyl)-N-[[6-(4-morpholinyl)-3-pyridinyl]methyl]-5-oxo-2-thiophen-2-yl-3-pyrrolidinecarboxamide IUPAC Name: (2R,3S)-1-(4-methylphenyl)-N-[(6-morpholin-4-ylpyridin-3-yl)methyl]-5-oxo-2-thiophen-2-ylpyrrolidine-3-carboxamide Traditional Name: (2R,3S)-5-keto-N-[(6-morpholino-3-pyridyl)methyl]-1-(p-tolyl)-2-(2-thienyl)pyrrolidine-3-carboxamide Formula: C26H28N4O3S MolecularWeight: 476.59052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CC2=O)C(=O)NCC3=CN=C(C=C3)N4CCOCC4)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)N2[C@H]([C@H](CC2=O)C(=O)NCC3=CN=C(C=C3)N4CCOCC4)C5=CC=CS5

InChI

InChI=1S/C26H28N4O3S/c1-18-4-7-20(8-5-18)30-24(31)15-21(25(30)22-3-2-14-34-22)26(32)28-17-19-6-9-23(27-16-19)29-10-12-33-13-11-29/h2-9,14,16,21,25H,10-13,15,17H2,1H3,(H,28,32)/t21-,25+/m0/s1