ethyl 4-[(4-cyclopropylcarbonyl-3-methyl-piperazin-1-yl)methyl]-6-(2,4-dichlorophenyl)-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(4-cyclopropylcarbonyl-3-methyl-piperazin-1-yl)methyl]-6-(2,4-dichlorophenyl)-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-allyl-4-[[4-(cyclopropanecarbonyl)-3-methyl-piperazin-1-yl]methyl]-6-(2,4-dichlorophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-[[4-[cyclopropyl(oxo)methyl]-3-methyl-1-piperazinyl]methyl]-6-(2,4-dichlorophenyl)-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(cyclopropanecarbonyl)-3-methylpiperazin-1-yl]methyl]-6-(2,4-dichlorophenyl)-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-allyl-4-[[4-(cyclopropanecarbonyl)-3-methyl-piperazino]methyl]-6-(2,4-dichlorophenyl)-2-keto-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C26H32Cl2N4O4 MolecularWeight: 535.46268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=C(C=C(C=C2)Cl)Cl)CC=C)CN3CCN(C(C3)C)C(=O)C4CC4

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=C(C=C(C=C2)Cl)Cl)CC=C)CN3CCN(C(C3)C)C(=O)C4CC4

InChI

InChI=1S/C26H32Cl2N4O4/c1-4-10-32-21(15-30-11-12-31(16(3)14-30)24(33)17-6-7-17)22(25(34)36-5-2)23(29-26(32)35)19-9-8-18(27)13-20(19)28/h4,8-9,13,16-17,23H,1,5-7,10-12,14-15H2,2-3H3,(H,29,35)