propan-2-yl 6-methyl-4-(3-nitrophenyl)-2-oxidanylidene-3-[3-(3-phenylpropanoylamino)propyl]-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 6-methyl-4-(3-nitrophenyl)-2-oxidanylidene-3-[3-(3-phenylpropanoylamino)propyl]-1,4-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl 6-methyl-4-(3-nitrophenyl)-2-oxo-3-[3-(3-phenylpropanoylamino)propyl]-1,4-dihydropyrimidine-5-carboxylate CAS Name: 6-methyl-4-(3-nitrophenyl)-2-oxo-3-[3-[(1-oxo-3-phenylpropyl)amino]propyl]-1,4-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 6-methyl-4-(3-nitrophenyl)-2-oxo-3-[3-(3-phenylpropanoylamino)propyl]-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 3-[3-(hydrocinnamoylamino)propyl]-2-keto-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C27H32N4O6 MolecularWeight: 508.56618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1)CCCNC(=O)CCC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(N(C(=O)N1)CCCNC(=O)CCC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC(C)C

InChI

InChI=1S/C27H32N4O6/c1-18(2)37-26(33)24-19(3)29-27(34)30(25(24)21-11-7-12-22(17-21)31(35)36)16-8-15-28-23(32)14-13-20-9-5-4-6-10-20/h4-7,9-12,17-18,25H,8,13-16H2,1-3H3,(H,28,32)(H,29,34)