ethyl 4-[(4-cyclobutylcarbonylpiperazin-1-yl)methyl]-3-methyl-6-(3-methylphenyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(4-cyclobutylcarbonylpiperazin-1-yl)methyl]-3-methyl-6-(3-methylphenyl)-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]-3-methyl-6-(m-tolyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-[[4-[cyclobutyl(oxo)methyl]-1-piperazinyl]methyl]-3-methyl-6-(3-methylphenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]-3-methyl-6-(3-methylphenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 4-[[4-(cyclobutanecarbonyl)piperazino]methyl]-2-keto-3-methyl-6-(m-tolyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C25H34N4O4 MolecularWeight: 454.56186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=CC=C2)C)C)CN3CCN(CC3)C(=O)C4CCC4

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=CC=C2)C)C)CN3CCN(CC3)C(=O)C4CCC4

InChI

InChI=1S/C25H34N4O4/c1-4-33-24(31)21-20(16-28-11-13-29(14-12-28)23(30)18-8-6-9-18)27(3)25(32)26-22(21)19-10-5-7-17(2)15-19/h5,7,10,15,18,22H,4,6,8-9,11-14,16H2,1-3H3,(H,26,32)