methyl (6S)-6-(4-bromophenyl)-3-(2-methoxyethyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl (6S)-6-(4-bromophenyl)-3-(2-methoxyethyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6S)-6-(4-bromophenyl)-3-(2-methoxyethyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-6-(4-bromophenyl)-3-(2-methoxyethyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6S)-6-(4-bromophenyl)-3-(2-methoxyethyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-6-(4-bromophenyl)-3-(2-methoxyethyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C16H19BrN2O3S MolecularWeight: 399.30266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1CCOC)C2=CC=C(C=C2)Br)C(=O)OC

Isomeric SMILES

CC1=C([C@@H](NC(=S)N1CCOC)C2=CC=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C16H19BrN2O3S/c1-10-13(15(20)22-3)14(11-4-6-12(17)7-5-11)18-16(23)19(10)8-9-21-2/h4-7,14H,8-9H2,1-3H3,(H,18,23)/t14-/m0/s1