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

Systemtic Name: prop-2-enyl (6R)-6-[4-(cyanomethoxy)phenyl]-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: allyl (6R)-6-[4-(cyanomethoxy)phenyl]-4-methyl-3-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-[4-(cyanomethoxy)phenyl]-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (6R)-6-[4-(cyanomethoxy)phenyl]-4-methyl-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-[4-(cyanomethoxy)phenyl]-4-methyl-3-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid allyl ester Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2=CC=CC=C2)C3=CC=C(C=C3)OCC#N)C(=O)OCC=C

Isomeric SMILES

CC1=C([C@H](NC(=S)N1C2=CC=CC=C2)C3=CC=C(C=C3)OCC#N)C(=O)OCC=C

InChI

InChI=1S/C23H21N3O3S/c1-3-14-29-22(27)20-16(2)26(18-7-5-4-6-8-18)23(30)25-21(20)17-9-11-19(12-10-17)28-15-13-24/h3-12,21H,1,14-15H2,2H3,(H,25,30)/t21-/m1/s1