methyl (6R)-3-(6-methoxy-6-oxidanylidene-hexyl)-4-methyl-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl (6R)-3-(6-methoxy-6-oxidanylidene-hexyl)-4-methyl-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6R)-3-(6-methoxy-6-oxo-hexyl)-4-methyl-6-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-3-(6-methoxy-6-oxohexyl)-4-methyl-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6R)-3-(6-methoxy-6-oxohexyl)-4-methyl-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-3-(6-keto-6-methoxy-hexyl)-4-methyl-6-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1CCCCCC(=O)OC)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C([C@H](NC(=S)N1CCCCCC(=O)OC)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H26N2O4S/c1-14-17(19(24)26-3)18(15-10-6-4-7-11-15)21-20(27)22(14)13-9-5-8-12-16(23)25-2/h4,6-7,10-11,18H,5,8-9,12-13H2,1-3H3,(H,21,27)/t18-/m1/s1