methyl 4-[6-(4-bromophenyl)-5-(2-ethoxy-2-oxidanylidene-ethyl)-4-methyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl]butanoate

Systemtic Name: methyl 4-[6-(4-bromophenyl)-5-(2-ethoxy-2-oxidanylidene-ethyl)-4-methyl-2-oxidanylidene-1,6-dihydropyrimidin-3-yl]butanoate Openeye Name: methyl 4-[6-(4-bromophenyl)-5-(2-ethoxy-2-oxo-ethyl)-4-methyl-2-oxo-1,6-dihydropyrimidin-3-yl]butanoate CAS Name: 4-[6-(4-bromophenyl)-5-(2-ethoxy-2-oxoethyl)-4-methyl-2-oxo-1,6-dihydropyrimidin-3-yl]butanoic acid methyl ester IUPAC Name: methyl 4-[6-(4-bromophenyl)-5-(2-ethoxy-2-oxoethyl)-4-methyl-2-oxo-1,6-dihydropyrimidin-3-yl]butanoate Traditional Name: 4-[6-(4-bromophenyl)-5-(2-ethoxy-2-keto-ethyl)-2-keto-4-methyl-1,6-dihydropyrimidin-3-yl]butyric acid methyl ester Formula: C20H25BrN2O5 MolecularWeight: 453.3269

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(N(C(=O)NC1C2=CC=C(C=C2)Br)CCCC(=O)OC)C

Isomeric SMILES

CCOC(=O)CC1=C(N(C(=O)NC1C2=CC=C(C=C2)Br)CCCC(=O)OC)C

InChI

InChI=1S/C20H25BrN2O5/c1-4-28-18(25)12-16-13(2)23(11-5-6-17(24)27-3)20(26)22-19(16)14-7-9-15(21)10-8-14/h7-10,19H,4-6,11-12H2,1-3H3,(H,22,26)