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

Systemtic Name: methyl (4S)-1,3,6-trimethyl-2-oxidanylidene-4-thiophen-3-yl-4H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-1,3,6-trimethyl-2-oxo-4-(3-thienyl)-4H-pyrimidine-5-carboxylate CAS Name: (4S)-1,3,6-trimethyl-2-oxo-4-(3-thiophenyl)-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-1,3,6-trimethyl-2-oxo-4-thiophen-3-yl-4H-pyrimidine-5-carboxylate Traditional Name: (4S)-2-keto-1,3,6-trimethyl-4-(3-thienyl)-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C13H16N2O3S MolecularWeight: 280.34274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1C)C)C2=CSC=C2)C(=O)OC

Isomeric SMILES

CC1=C([C@H](N(C(=O)N1C)C)C2=CSC=C2)C(=O)OC

InChI

InChI=1S/C13H16N2O3S/c1-8-10(12(16)18-4)11(9-5-6-19-7-9)15(3)13(17)14(8)2/h5-7,11H,1-4H3/t11-/m1/s1