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

Systemtic Name: (6R)-N-(3-chlorophenyl)-3-cyclopropyl-6-(3-methoxy-4-oxidanyl-phenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Openeye Name: (6R)-N-(3-chlorophenyl)-3-cyclopropyl-6-(4-hydroxy-3-methoxy-phenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: (6R)-N-(3-chlorophenyl)-3-cyclopropyl-6-(4-hydroxy-3-methoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: (6R)-N-(3-chlorophenyl)-3-cyclopropyl-6-(4-hydroxy-3-methoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Traditional Name: (6R)-N-(3-chlorophenyl)-3-cyclopropyl-6-(4-hydroxy-3-methoxy-phenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C22H22ClN3O3S MolecularWeight: 443.94638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22ClN3O3S/c1-12-19(21(28)24-15-5-3-4-14(23)11-15)20(25-22(30)26(12)16-7-8-16)13-6-9-17(27)18(10-13)29-2/h3-6,9-11,16,20,27H,7-8H2,1-2H3,(H,24,28)(H,25,30)/t20-/m1/s1