ethyl 4-[[4-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-ethoxy-phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-5-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[4-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-ethoxy-phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-5-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[4-[4-(2-amino-2-oxo-ethoxy)-3-ethoxy-phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carbonyl]amino]benzoate CAS Name: 4-[[[4-[4-(2-amino-2-oxoethoxy)-3-ethoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-5-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[4-(2-amino-2-oxoethoxy)-3-ethoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carbonyl]amino]benzoate Traditional Name: 4-[[4-[4-(2-amino-2-keto-ethoxy)-3-ethoxy-phenyl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carbonyl]amino]benzoic acid ethyl ester Formula: C25H28N4O7 MolecularWeight: 496.51242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(NC(=O)N2)C)C(=O)NC3=CC=C(C=C3)C(=O)OCC)OCC(=O)N

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(NC(=O)N2)C)C(=O)NC3=CC=C(C=C3)C(=O)OCC)OCC(=O)N

InChI

InChI=1S/C25H28N4O7/c1-4-34-19-12-16(8-11-18(19)36-13-20(26)30)22-21(14(3)27-25(33)29-22)23(31)28-17-9-6-15(7-10-17)24(32)35-5-2/h6-12,22H,4-5,13H2,1-3H3,(H2,26,30)(H,28,31)(H2,27,29,33)