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

Systemtic Name: methyl 2-(decylcarbamothioylamino)-4-ethyl-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-(decylcarbamothioylamino)-4-ethyl-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(decylamino)-sulfanylidenemethyl]amino]-4-ethyl-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(decylcarbamothioylamino)-4-ethyl-5-methylthiophene-3-carboxylate Traditional Name: 2-(decylthiocarbamoylamino)-4-ethyl-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C20H34N2O2S2 MolecularWeight: 398.62616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H34N2O2S2/c1-5-7-8-9-10-11-12-13-14-21-20(25)22-18-17(19(23)24-4)16(6-2)15(3)26-18/h5-14H2,1-4H3,(H2,21,22,25)