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

Systemtic Name: methyl (6S)-3-butyl-4-methyl-2-sulfanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6S)-3-butyl-4-methyl-6-(3-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-3-butyl-4-methyl-2-sulfanylidene-6-(3-thiophenyl)-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6S)-3-butyl-4-methyl-2-sulfanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-butyl-4-methyl-6-(3-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C15H20N2O2S2 MolecularWeight: 324.4615

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(NC1=S)C2=CSC=C2)C(=O)OC)C

Isomeric SMILES

CCCCN1C(=C([C@H](NC1=S)C2=CSC=C2)C(=O)OC)C

InChI

InChI=1S/C15H20N2O2S2/c1-4-5-7-17-10(2)12(14(18)19-3)13(16-15(17)20)11-6-8-21-9-11/h6,8-9,13H,4-5,7H2,1-3H3,(H,16,20)/t13-/m1/s1