methyl 6-methyl-4-sulfanylidene-2-(3-thiophen-2-ylpropyl)-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 6-methyl-4-sulfanylidene-2-(3-thiophen-2-ylpropyl)-1H-pyrimidine-5-carboxylate Openeye Name: methyl 6-methyl-2-[3-(2-thienyl)propyl]-4-thioxo-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-4-sulfanylidene-2-(3-thiophen-2-ylpropyl)-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-methyl-4-sulfanylidene-2-(3-thiophen-2-ylpropyl)-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-2-[3-(2-thienyl)propyl]-4-thioxo-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C14H16N2O2S2 MolecularWeight: 308.41904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=S)N=C(N1)CCCC2=CC=CS2)C(=O)OC

Isomeric SMILES

CC1=C(C(=S)N=C(N1)CCCC2=CC=CS2)C(=O)OC

InChI

InChI=1S/C14H16N2O2S2/c1-9-12(14(17)18-2)13(19)16-11(15-9)7-3-5-10-6-4-8-20-10/h4,6,8H,3,5,7H2,1-2H3,(H,15,16,19)