methyl 5-ethyl-2-(hexylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: methyl 5-ethyl-2-(hexylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: methyl 5-ethyl-2-(hexylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[(hexylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-ethyl-2-(hexylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 5-ethyl-2-(hexylthiocarbamoylamino)thiophene-3-carboxylic acid methyl ester Formula: C15H24N2O2S2 MolecularWeight: 328.49326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=S)NC1=C(C=C(S1)CC)C(=O)OC

Isomeric SMILES

CCCCCCNC(=S)NC1=C(C=C(S1)CC)C(=O)OC

InChI

InChI=1S/C15H24N2O2S2/c1-4-6-7-8-9-16-15(20)17-13-12(14(18)19-3)10-11(5-2)21-13/h10H,4-9H2,1-3H3,(H2,16,17,20)