3-phenylpropyl (4S)-6-methyl-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 3-phenylpropyl (4S)-6-methyl-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 3-phenylpropyl (4S)-6-methyl-2-oxo-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-methyl-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl (4S)-6-methyl-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-2-keto-6-methyl-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 3-phenylpropyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1)C2=CC=CS2)C(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

CC1=C([C@H](NC(=O)N1)C2=CC=CS2)C(=O)OCCCC3=CC=CC=C3

InChI

InChI=1S/C19H20N2O3S/c1-13-16(17(21-19(23)20-13)15-10-6-12-25-15)18(22)24-11-5-9-14-7-3-2-4-8-14/h2-4,6-8,10,12,17H,5,9,11H2,1H3,(H2,20,21,23)/t17-/m1/s1