methyl 2-(cyclooctylcarbamothioylamino)-4-ethyl-5-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-(cyclooctylcarbamothioylamino)-4-ethyl-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-(cyclooctylcarbamothioylamino)-4-ethyl-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(cyclooctylamino)-sulfanylidenemethyl]amino]-4-ethyl-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(cyclooctylcarbamothioylamino)-4-ethyl-5-methylthiophene-3-carboxylate Traditional Name: 2-(cyclooctylthiocarbamoylamino)-4-ethyl-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C18H28N2O2S2 MolecularWeight: 368.55712

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC)NC(=S)NC2CCCCCCC2)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC)NC(=S)NC2CCCCCCC2)C

InChI

InChI=1S/C18H28N2O2S2/c1-4-14-12(2)24-16(15(14)17(21)22-3)20-18(23)19-13-10-8-6-5-7-9-11-13/h13H,4-11H2,1-3H3,(H2,19,20,23)