methyl 4,5-dimethyl-2-(pentan-3-ylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-(pentan-3-ylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: methyl 2-(1-ethylpropylcarbamothioylamino)-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[(pentan-3-ylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-(pentan-3-ylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 2-(1-ethylpropylthiocarbamoylamino)-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C14H22N2O2S2 MolecularWeight: 314.46668

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=S)NC1=C(C(=C(S1)C)C)C(=O)OC

Isomeric SMILES

CCC(CC)NC(=S)NC1=C(C(=C(S1)C)C)C(=O)OC

InChI

InChI=1S/C14H22N2O2S2/c1-6-10(7-2)15-14(19)16-12-11(13(17)18-5)8(3)9(4)20-12/h10H,6-7H2,1-5H3,(H2,15,16,19)