ethyl 3-ethyl-2-oxidanylidene-4-[[4-(phenylcarbonyl)piperazin-1-yl]methyl]-6-(4-propan-2-ylphenyl)-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-ethyl-2-oxidanylidene-4-[[4-(phenylcarbonyl)piperazin-1-yl]methyl]-6-(4-propan-2-ylphenyl)-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-[(4-benzoylpiperazin-1-yl)methyl]-3-ethyl-6-(4-isopropylphenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-[(4-benzoyl-1-piperazinyl)methyl]-3-ethyl-2-oxo-6-(4-propan-2-ylphenyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-benzoylpiperazin-1-yl)methyl]-3-ethyl-2-oxo-6-(4-propan-2-ylphenyl)-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 4-[(4-benzoylpiperazino)methyl]-3-ethyl-2-keto-6-p-cumenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C30H38N4O4 MolecularWeight: 518.64712

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC=C(C=C2)C(C)C)C(=O)OCC)CN3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CC=C(C=C2)C(C)C)C(=O)OCC)CN3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C30H38N4O4/c1-5-34-25(20-32-16-18-33(19-17-32)28(35)24-10-8-7-9-11-24)26(29(36)38-6-2)27(31-30(34)37)23-14-12-22(13-15-23)21(3)4/h7-15,21,27H,5-6,16-20H2,1-4H3,(H,31,37)