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

Systemtic Name: ethyl (4S)-4-(4-bromanylthiophen-2-yl)-1,3,6-trimethyl-2-oxidanylidene-4H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-(4-bromo-2-thienyl)-1,3,6-trimethyl-2-oxo-4H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(4-bromo-2-thiophenyl)-1,3,6-trimethyl-2-oxo-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-(4-bromothiophen-2-yl)-1,3,6-trimethyl-2-oxo-4H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(4-bromo-2-thienyl)-2-keto-1,3,6-trimethyl-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C14H17BrN2O3S MolecularWeight: 373.26538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)N(C1C2=CC(=CS2)Br)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)N([C@@H]1C2=CC(=CS2)Br)C)C)C

InChI

InChI=1S/C14H17BrN2O3S/c1-5-20-13(18)11-8(2)16(3)14(19)17(4)12(11)10-6-9(15)7-21-10/h6-7,12H,5H2,1-4H3/t12-/m1/s1