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

Systemtic Name: methyl 2-(dipentylcarbamothioylamino)-4-ethyl-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-(dipentylcarbamothioylamino)-4-ethyl-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(dipentylamino)-sulfanylidenemethyl]amino]-4-ethyl-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(dipentylcarbamothioylamino)-4-ethyl-5-methylthiophene-3-carboxylate Traditional Name: 2-(diamylthiocarbamoylamino)-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:

CCCCCN(CCCCC)C(=S)NC1=C(C(=C(S1)C)CC)C(=O)OC

Isomeric SMILES

CCCCCN(CCCCC)C(=S)NC1=C(C(=C(S1)C)CC)C(=O)OC

InChI

InChI=1S/C20H34N2O2S2/c1-6-9-11-13-22(14-12-10-7-2)20(25)21-18-17(19(23)24-5)16(8-3)15(4)26-18/h6-14H2,1-5H3,(H,21,25)