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

Systemtic Name: [(2S)-2-methylpentyl] (4R)-4-[4-(diethylamino)phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: [(2S)-2-methylpentyl] (4R)-4-[4-(diethylamino)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-4-[4-(diethylamino)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid [(2S)-2-methylpentyl] ester IUPAC Name: [(2S)-2-methylpentyl] (4R)-4-[4-(diethylamino)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-4-[4-(diethylamino)phenyl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid [(2S)-2-methylpentyl] ester Formula: C22H33N3O3 MolecularWeight: 387.51572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H33N3O3/c1-6-9-15(4)14-28-21(26)19-16(5)23-22(27)24-20(19)17-10-12-18(13-11-17)25(7-2)8-3/h10-13,15,20H,6-9,14H2,1-5H3,(H2,23,24,27)/t15-,20+/m0/s1