(6R)-6-(4-acetamidophenyl)-N-(3-chlorophenyl)-3-cyclopropyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide

Systemtic Name: (6R)-6-(4-acetamidophenyl)-N-(3-chlorophenyl)-3-cyclopropyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Openeye Name: (6R)-6-(4-acetamidophenyl)-N-(3-chlorophenyl)-3-cyclopropyl-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: (6R)-6-(4-acetamidophenyl)-N-(3-chlorophenyl)-3-cyclopropyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: (6R)-6-(4-acetamidophenyl)-N-(3-chlorophenyl)-3-cyclopropyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Traditional Name: (6R)-6-(4-acetamidophenyl)-N-(3-chlorophenyl)-3-cyclopropyl-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C23H23ClN4O2S MolecularWeight: 454.97232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2CC2)C3=CC=C(C=C3)NC(=O)C)C(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C([C@H](NC(=S)N1C2CC2)C3=CC=C(C=C3)NC(=O)C)C(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H23ClN4O2S/c1-13-20(22(30)26-18-5-3-4-16(24)12-18)21(27-23(31)28(13)19-10-11-19)15-6-8-17(9-7-15)25-14(2)29/h3-9,12,19,21H,10-11H2,1-2H3,(H,25,29)(H,26,30)(H,27,31)/t21-/m1/s1