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

Systemtic Name: ethyl 2-oxidanylidene-6-phenyl-3-prop-2-enyl-4-[[4-(propylcarbamoyl)piperazin-1-yl]methyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-allyl-2-oxo-6-phenyl-4-[[4-(propylcarbamoyl)piperazin-1-yl]methyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: 2-oxo-4-[[4-[oxo(propylamino)methyl]-1-piperazinyl]methyl]-6-phenyl-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-oxo-6-phenyl-3-prop-2-enyl-4-[[4-(propylcarbamoyl)piperazin-1-yl]methyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-allyl-2-keto-6-phenyl-4-[[4-(propylcarbamoyl)piperazino]methyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C25H35N5O4 MolecularWeight: 469.5765

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1CCN(CC1)CC2=C(C(NC(=O)N2CC=C)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCCNC(=O)N1CCN(CC1)CC2=C(C(NC(=O)N2CC=C)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C25H35N5O4/c1-4-12-26-24(32)29-16-14-28(15-17-29)18-20-21(23(31)34-6-3)22(19-10-8-7-9-11-19)27-25(33)30(20)13-5-2/h5,7-11,22H,2,4,6,12-18H2,1,3H3,(H,26,32)(H,27,33)