(6S)-6-(4-bromophenyl)-3,4-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide

Systemtic Name: (6S)-6-(4-bromophenyl)-3,4-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Openeye Name: (6S)-6-(4-bromophenyl)-3,4-dimethyl-N-(5-methylisoxazol-3-yl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: (6S)-6-(4-bromophenyl)-3,4-dimethyl-N-(5-methyl-3-isoxazolyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: (6S)-6-(4-bromophenyl)-3,4-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Traditional Name: (6S)-6-(4-bromophenyl)-3,4-dimethyl-N-(5-methylisoxazol-3-yl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C17H17BrN4O2S MolecularWeight: 421.31148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C2=C(N(C(=S)NC2C3=CC=C(C=C3)Br)C)C

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C2=C(N(C(=S)N[C@H]2C3=CC=C(C=C3)Br)C)C

InChI

InChI=1S/C17H17BrN4O2S/c1-9-8-13(21-24-9)19-16(23)14-10(2)22(3)17(25)20-15(14)11-4-6-12(18)7-5-11/h4-8,15H,1-3H3,(H,20,25)(H,19,21,23)/t15-/m0/s1