[(2S)-2-methylpentyl] (4R)-6-methyl-2-oxidanylidene-4-(4-propoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: [(2S)-2-methylpentyl] (4R)-6-methyl-2-oxidanylidene-4-(4-propoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: [(2S)-2-methylpentyl] (4R)-6-methyl-2-oxo-4-(4-propoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-methyl-2-oxo-4-(4-propoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid [(2S)-2-methylpentyl] ester IUPAC Name: [(2S)-2-methylpentyl] (4R)-6-methyl-2-oxo-4-(4-propoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-2-keto-6-methyl-4-(4-propoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid [(2S)-2-methylpentyl] ester Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)COC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OCCC)C

Isomeric SMILES

CCC[C@H](C)COC(=O)C1=C(NC(=O)N[C@@H]1C2=CC=C(C=C2)OCCC)C

InChI

InChI=1S/C21H30N2O4/c1-5-7-14(3)13-27-20(24)18-15(4)22-21(25)23-19(18)16-8-10-17(11-9-16)26-12-6-2/h8-11,14,19H,5-7,12-13H2,1-4H3,(H2,22,23,25)/t14-,19+/m0/s1