methyl 2-[[4-butyl-5-[[4-(2-methoxycarbonylphenyl)phenyl]methyl]-2-methyl-6-oxidanylidene-pyrimidin-1-yl]methyl]thiophene-3-carboxylate

Systemtic Name: methyl 2-[[4-butyl-5-[[4-(2-methoxycarbonylphenyl)phenyl]methyl]-2-methyl-6-oxidanylidene-pyrimidin-1-yl]methyl]thiophene-3-carboxylate Openeye Name: methyl 2-[[4-butyl-5-[[4-(2-methoxycarbonylphenyl)phenyl]methyl]-2-methyl-6-oxo-pyrimidin-1-yl]methyl]thiophene-3-carboxylate CAS Name: 2-[[4-butyl-5-[[4-(2-methoxycarbonylphenyl)phenyl]methyl]-2-methyl-6-oxo-1-pyrimidinyl]methyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-butyl-5-[[4-(2-methoxycarbonylphenyl)phenyl]methyl]-2-methyl-6-oxopyrimidin-1-yl]methyl]thiophene-3-carboxylate Traditional Name: 2-[[4-butyl-5-[4-(2-carbomethoxyphenyl)benzyl]-6-keto-2-methyl-pyrimidin-1-yl]methyl]thiophene-3-carboxylic acid methyl ester Formula: C31H32N2O5S MolecularWeight: 544.66118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)N(C(=N1)C)CC2=C(C=CS2)C(=O)OC)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC

Isomeric SMILES

CCCCC1=C(C(=O)N(C(=N1)C)CC2=C(C=CS2)C(=O)OC)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C31H32N2O5S/c1-5-6-11-27-26(29(34)33(20(2)32-27)19-28-25(16-17-39-28)31(36)38-4)18-21-12-14-22(15-13-21)23-9-7-8-10-24(23)30(35)37-3/h7-10,12-17H,5-6,11,18-19H2,1-4H3