cyclohexylmethyl 4-(4-aminophenyl)-6-cyclopropyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: cyclohexylmethyl 4-(4-aminophenyl)-6-cyclopropyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: cyclohexylmethyl 4-(4-aminophenyl)-6-cyclopropyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(4-aminophenyl)-6-cyclopropyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 4-(4-aminophenyl)-6-cyclopropyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(4-aminophenyl)-6-cyclopropyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid cyclohexylmethyl ester Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC(=O)C2=C(NC(=O)NC2C3=CC=C(C=C3)N)C4CC4

Isomeric SMILES

C1CCC(CC1)COC(=O)C2=C(NC(=O)NC2C3=CC=C(C=C3)N)C4CC4

InChI

InChI=1S/C21H27N3O3/c22-16-10-8-15(9-11-16)19-17(18(14-6-7-14)23-21(26)24-19)20(25)27-12-13-4-2-1-3-5-13/h8-11,13-14,19H,1-7,12,22H2,(H2,23,24,26)