propan-2-yl (6R)-6-(4-benzamidophenyl)-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: propan-2-yl (6R)-6-(4-benzamidophenyl)-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl (6R)-6-(4-benzamidophenyl)-3,4-dimethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-(4-benzamidophenyl)-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (6R)-6-(4-benzamidophenyl)-3,4-dimethyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-(4-benzamidophenyl)-3,4-dimethyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)C(=O)OC(C)C

Isomeric SMILES

CC1=C([C@H](NC(=S)N1C)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)C(=O)OC(C)C

InChI

InChI=1S/C23H25N3O3S/c1-14(2)29-22(28)19-15(3)26(4)23(30)25-20(19)16-10-12-18(13-11-16)24-21(27)17-8-6-5-7-9-17/h5-14,20H,1-4H3,(H,24,27)(H,25,30)/t20-/m1/s1