[4-(3-chlorophenyl)-5-(ethylcarbamoyl)-6-methyl-2,4-dihydro-1H-pyrimidin-3-yl] 2-oxidanylidenebutanoate; pyridine

Systemtic Name: [4-(3-chlorophenyl)-5-(ethylcarbamoyl)-6-methyl-2,4-dihydro-1H-pyrimidin-3-yl] 2-oxidanylidenebutanoate; pyridine Openeye Name: [4-(3-chlorophenyl)-5-(ethylcarbamoyl)-6-methyl-2,4-dihydro-1H-pyrimidin-3-yl] 2-oxobutanoate; pyridine CAS Name: 2-oxobutanoic acid [4-(3-chlorophenyl)-5-(ethylcarbamoyl)-6-methyl-2,4-dihydro-1H-pyrimidin-3-yl] ester; pyridine IUPAC Name: [4-(3-chlorophenyl)-5-(ethylcarbamoyl)-6-methyl-2,4-dihydro-1H-pyrimidin-3-yl] 2-oxobutanoate; pyridine Traditional Name: 2-ketobutyric acid [4-(3-chlorophenyl)-5-(ethylcarbamoyl)-6-methyl-2,4-dihydro-1H-pyrimidin-3-yl] ester; pyridine Formula: C23H27ClN4O4 MolecularWeight: 458.93788

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(=O)ON1CNC(=C(C1C2=CC(=CC=C2)Cl)C(=O)NCC)C.C1=CC=NC=C1

Isomeric SMILES

CCC(=O)C(=O)ON1CNC(=C(C1C2=CC(=CC=C2)Cl)C(=O)NCC)C.C1=CC=NC=C1

InChI

InChI=1S/C18H22ClN3O4.C5H5N/c1-4-14(23)18(25)26-22-10-21-11(3)15(17(24)20-5-2)16(22)12-7-6-8-13(19)9-12;1-2-4-6-5-3-1/h6-9,16,21H,4-5,10H2,1-3H3,(H,20,24);1-5H