methyl (6S)-3-(6-methoxy-6-oxidanylidene-hexyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl (6S)-3-(6-methoxy-6-oxidanylidene-hexyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6S)-3-(6-methoxy-6-oxo-hexyl)-4-methyl-6-(2-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-3-(6-methoxy-6-oxohexyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6S)-3-(6-methoxy-6-oxohexyl)-4-methyl-2-sulfanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-(6-keto-6-methoxy-hexyl)-4-methyl-6-(2-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C18H24N2O4S2 MolecularWeight: 396.52416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1CCCCCC(=O)OC)C2=CC=CS2)C(=O)OC

Isomeric SMILES

CC1=C([C@H](NC(=S)N1CCCCCC(=O)OC)C2=CC=CS2)C(=O)OC

InChI

InChI=1S/C18H24N2O4S2/c1-12-15(17(22)24-3)16(13-8-7-11-26-13)19-18(25)20(12)10-6-4-5-9-14(21)23-2/h7-8,11,16H,4-6,9-10H2,1-3H3,(H,19,25)/t16-/m1/s1