ethyl 6-[[cyclopropyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[cyclopropyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[cyclopropyl-[(4-isopropylphenyl)methyl]amino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[cyclopropyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[cyclopropyl-[(4-propan-2-ylphenyl)methyl]amino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[cyclopropyl-(4-isopropylbenzyl)amino]methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CN(CC2=CC=C(C=C2)C(C)C)C3CC3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CN(CC2=CC=C(C=C2)C(C)C)C3CC3

InChI

InChI=1S/C21H29N3O3/c1-4-27-20(25)18-11-22-21(26)23-19(18)13-24(17-9-10-17)12-15-5-7-16(8-6-15)14(2)3/h5-8,14,17H,4,9-13H2,1-3H3,(H2,22,23,26)