ethyl (4S)-6-[[methyl(thiophen-3-ylmethyl)amino]methyl]-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-6-[[methyl(thiophen-3-ylmethyl)amino]methyl]-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[[methyl(3-thienylmethyl)amino]methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[[methyl(3-thiophenylmethyl)amino]methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[[methyl(thiophen-3-ylmethyl)amino]methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-2-keto-6-[[methyl(3-thenyl)amino]methyl]-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CN(C)CC3=CSC=C3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C2=CC=CC=C2)CN(C)CC3=CSC=C3

InChI

InChI=1S/C20H23N3O3S/c1-3-26-19(24)17-16(12-23(2)11-14-9-10-27-13-14)21-20(25)22-18(17)15-7-5-4-6-8-15/h4-10,13,18H,3,11-12H2,1-2H3,(H2,21,22,25)/t18-/m0/s1