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

Systemtic Name: ethyl 6-(2,4-dichlorophenyl)-4-[(3-methyl-4-propanoyl-piperazin-1-yl)methyl]-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-allyl-6-(2,4-dichlorophenyl)-4-[(3-methyl-4-propanoyl-piperazin-1-yl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(2,4-dichlorophenyl)-4-[[3-methyl-4-(1-oxopropyl)-1-piperazinyl]methyl]-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(2,4-dichlorophenyl)-4-[(3-methyl-4-propanoylpiperazin-1-yl)methyl]-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-allyl-6-(2,4-dichlorophenyl)-2-keto-4-[(3-methyl-4-propionyl-piperazino)methyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C25H32Cl2N4O4 MolecularWeight: 523.45198

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1C)CC2=C(C(NC(=O)N2CC=C)C3=C(C=C(C=C3)Cl)Cl)C(=O)OCC

Isomeric SMILES

CCC(=O)N1CCN(CC1C)CC2=C(C(NC(=O)N2CC=C)C3=C(C=C(C=C3)Cl)Cl)C(=O)OCC

InChI

InChI=1S/C25H32Cl2N4O4/c1-5-10-31-20(15-29-11-12-30(16(4)14-29)21(32)6-2)22(24(33)35-7-3)23(28-25(31)34)18-9-8-17(26)13-19(18)27/h5,8-9,13,16,23H,1,6-7,10-12,14-15H2,2-4H3,(H,28,34)