(3S)-1-(3-chloranyl-4-methyl-phenyl)-5-oxidanylidene-N-pyrimidin-2-yl-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-(3-chloranyl-4-methyl-phenyl)-5-oxidanylidene-N-pyrimidin-2-yl-pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(3-chloro-4-methyl-phenyl)-5-oxo-N-pyrimidin-2-yl-pyrrolidine-3-carboxamide CAS Name: (3S)-1-(3-chloro-4-methylphenyl)-5-oxo-N-(2-pyrimidinyl)-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-(3-chloro-4-methylphenyl)-5-oxo-N-pyrimidin-2-ylpyrrolidine-3-carboxamide Traditional Name: (3S)-1-(3-chloro-4-methyl-phenyl)-5-keto-N-(2-pyrimidyl)pyrrolidine-3-carboxamide Formula: C16H15ClN4O2 MolecularWeight: 330.7689

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NC3=NC=CC=N3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C[C@H](CC2=O)C(=O)NC3=NC=CC=N3)Cl

InChI

InChI=1S/C16H15ClN4O2/c1-10-3-4-12(8-13(10)17)21-9-11(7-14(21)22)15(23)20-16-18-5-2-6-19-16/h2-6,8,11H,7,9H2,1H3,(H,18,19,20,23)/t11-/m0/s1