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

Systemtic Name: (3S)-1-(4-ethoxyphenyl)-5-oxidanylidene-N-pyrimidin-2-yl-pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(4-ethoxyphenyl)-5-oxo-N-pyrimidin-2-yl-pyrrolidine-3-carboxamide CAS Name: (3S)-1-(4-ethoxyphenyl)-5-oxo-N-(2-pyrimidinyl)-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(4-ethoxyphenyl)-5-oxo-N-pyrimidin-2-ylpyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-1-p-phenetyl-N-(2-pyrimidyl)pyrrolidine-3-carboxamide Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=NC=CC=N3

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C[C@H](CC2=O)C(=O)NC3=NC=CC=N3

InChI

InChI=1S/C17H18N4O3/c1-2-24-14-6-4-13(5-7-14)21-11-12(10-15(21)22)16(23)20-17-18-8-3-9-19-17/h3-9,12H,2,10-11H2,1H3,(H,18,19,20,23)/t12-/m0/s1