(3S)-1-(2,4-dimethoxyphenyl)-5-oxidanylidene-N-pyrimidin-2-yl-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-(2,4-dimethoxyphenyl)-5-oxidanylidene-N-pyrimidin-2-yl-pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(2,4-dimethoxyphenyl)-5-oxo-N-pyrimidin-2-yl-pyrrolidine-3-carboxamide CAS Name: (3S)-1-(2,4-dimethoxyphenyl)-5-oxo-N-(2-pyrimidinyl)-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(2,4-dimethoxyphenyl)-5-oxo-N-pyrimidin-2-ylpyrrolidine-3-carboxamide Traditional Name: (3S)-1-(2,4-dimethoxyphenyl)-5-keto-N-(2-pyrimidyl)pyrrolidine-3-carboxamide Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2CC(CC2=O)C(=O)NC3=NC=CC=N3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)N2C[C@H](CC2=O)C(=O)NC3=NC=CC=N3)OC

InChI

InChI=1S/C17H18N4O4/c1-24-12-4-5-13(14(9-12)25-2)21-10-11(8-15(21)22)16(23)20-17-18-6-3-7-19-17/h3-7,9,11H,8,10H2,1-2H3,(H,18,19,20,23)/t11-/m0/s1