[(4S)-4-(4-chlorophenyl)-5-ethoxycarbonyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: [(4S)-4-(4-chlorophenyl)-5-ethoxycarbonyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: [(4S)-4-(4-chlorophenyl)-5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid [(4S)-4-(4-chlorophenyl)-5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl ester IUPAC Name: [(4S)-4-(4-chlorophenyl)-5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid [(4S)-5-carbethoxy-4-(4-chlorophenyl)-2-keto-3,4-dihydro-1H-pyrimidin-6-yl]methyl ester Formula: C24H21ClN4O6 MolecularWeight: 496.89974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)Cl)COC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C2=CC=C(C=C2)Cl)COC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C24H21ClN4O6/c1-3-34-22(31)18-17(26-24(33)27-19(18)13-8-10-14(25)11-9-13)12-35-23(32)20-15-6-4-5-7-16(15)21(30)29(2)28-20/h4-11,19H,3,12H2,1-2H3,(H2,26,27,33)/t19-/m0/s1