methyl 2-(cyclooctylcarbamothioylamino)-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-(cyclooctylcarbamothioylamino)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-(cyclooctylcarbamothioylamino)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(cyclooctylamino)-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(cyclooctylcarbamothioylamino)-5-methylthiophene-3-carboxylate Traditional Name: 2-(cyclooctylthiocarbamoylamino)-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C16H24N2O2S2 MolecularWeight: 340.50396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=S)NC2CCCCCCC2)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=S)NC2CCCCCCC2)C(=O)OC

InChI

InChI=1S/C16H24N2O2S2/c1-11-10-13(15(19)20-2)14(22-11)18-16(21)17-12-8-6-4-3-5-7-9-12/h10,12H,3-9H2,1-2H3,(H2,17,18,21)