methyl (6R)-6-[4-(cyanomethoxy)phenyl]-3-phenyl-4-propan-2-yl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl (6R)-6-[4-(cyanomethoxy)phenyl]-3-phenyl-4-propan-2-yl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6R)-6-[4-(cyanomethoxy)phenyl]-4-isopropyl-3-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-[4-(cyanomethoxy)phenyl]-3-phenyl-4-propan-2-yl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6R)-6-[4-(cyanomethoxy)phenyl]-3-phenyl-4-propan-2-yl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-[4-(cyanomethoxy)phenyl]-4-isopropyl-3-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(NC(=S)N1C2=CC=CC=C2)C3=CC=C(C=C3)OCC#N)C(=O)OC

Isomeric SMILES

CC(C)C1=C([C@H](NC(=S)N1C2=CC=CC=C2)C3=CC=C(C=C3)OCC#N)C(=O)OC

InChI

InChI=1S/C23H23N3O3S/c1-15(2)21-19(22(27)28-3)20(16-9-11-18(12-10-16)29-14-13-24)25-23(30)26(21)17-7-5-4-6-8-17/h4-12,15,20H,14H2,1-3H3,(H,25,30)/t20-/m1/s1