methyl 6-methyl-4-sulfanylidene-2-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 6-methyl-4-sulfanylidene-2-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1H-pyrimidine-5-carboxylate Openeye Name: methyl 6-methyl-2-(4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-thioxo-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-4-sulfanylidene-2-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-methyl-4-sulfanylidene-2-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-2-(4,5,6,7-tetrahydrobenzothiophen-2-yl)-4-thioxo-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C15H16N2O2S2 MolecularWeight: 320.42974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=S)N=C(N1)C2=CC3=C(S2)CCCC3)C(=O)OC

Isomeric SMILES

CC1=C(C(=S)N=C(N1)C2=CC3=C(S2)CCCC3)C(=O)OC

InChI

InChI=1S/C15H16N2O2S2/c1-8-12(15(18)19-2)14(20)17-13(16-8)11-7-9-5-3-4-6-10(9)21-11/h7H,3-6H2,1-2H3,(H,16,17,20)