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

Systemtic Name: ethyl 6-[[[(1S)-2-methyl-1-(4-propan-2-ylphenyl)propyl]amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[[(1S)-1-(4-isopropylphenyl)-2-methyl-propyl]amino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[[(1S)-2-methyl-1-(4-propan-2-ylphenyl)propyl]amino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[[(1S)-2-methyl-1-(4-propan-2-ylphenyl)propyl]amino]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-[[[(1S)-2-methyl-1-p-cumenyl-propyl]amino]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CNC(C2=CC=C(C=C2)C(C)C)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CN[C@H](C2=CC=C(C=C2)C(C)C)C(C)C

InChI

InChI=1S/C21H31N3O3/c1-6-27-20(25)17-11-23-21(26)24-18(17)12-22-19(14(4)5)16-9-7-15(8-10-16)13(2)3/h7-10,13-14,19,22H,6,11-12H2,1-5H3,(H2,23,24,26)/t19-/m0/s1