methyl 2-[1-(4-butan-2-ylphenyl)propylcarbamothioylamino]-4-ethyl-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[1-(4-butan-2-ylphenyl)propylcarbamothioylamino]-4-ethyl-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 4-ethyl-5-methyl-2-[1-(4-sec-butylphenyl)propylcarbamothioylamino]thiophene-3-carboxylate CAS Name: 2-[[[1-(4-butan-2-ylphenyl)propylamino]-sulfanylidenemethyl]amino]-4-ethyl-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[1-(4-butan-2-ylphenyl)propylcarbamothioylamino]-4-ethyl-5-methylthiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-[1-(4-sec-butylphenyl)propylthiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C23H32N2O2S2 MolecularWeight: 432.64238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC)NC(=S)NC(CC)C2=CC=C(C=C2)C(C)CC)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC)NC(=S)NC(CC)C2=CC=C(C=C2)C(C)CC)C

InChI

InChI=1S/C23H32N2O2S2/c1-7-14(4)16-10-12-17(13-11-16)19(9-3)24-23(28)25-21-20(22(26)27-6)18(8-2)15(5)29-21/h10-14,19H,7-9H2,1-6H3,(H2,24,25,28)