methyl 6-(4-bromanylthiophen-2-yl)-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 6-(4-bromanylthiophen-2-yl)-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 6-(4-bromo-2-thienyl)-4-methyl-3-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-bromo-2-thiophenyl)-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-(4-bromothiophen-2-yl)-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(4-bromo-2-thienyl)-4-methyl-3-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C17H15BrN2O2S2 MolecularWeight: 423.3472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2=CC=CC=C2)C3=CC(=CS3)Br)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=S)N1C2=CC=CC=C2)C3=CC(=CS3)Br)C(=O)OC

InChI

InChI=1S/C17H15BrN2O2S2/c1-10-14(16(21)22-2)15(13-8-11(18)9-24-13)19-17(23)20(10)12-6-4-3-5-7-12/h3-9,15H,1-2H3,(H,19,23)