methyl 2-(butylcarbamothioylamino)-4-(2-methylpropyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-(butylcarbamothioylamino)-4-(2-methylpropyl)thiophene-3-carboxylate Openeye Name: methyl 2-(butylcarbamothioylamino)-4-isobutyl-thiophene-3-carboxylate CAS Name: 2-[[butylamino(sulfanylidene)methyl]amino]-4-(2-methylpropyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(butylcarbamothioylamino)-4-(2-methylpropyl)thiophene-3-carboxylate Traditional Name: 2-(butylthiocarbamoylamino)-4-isobutyl-thiophene-3-carboxylic acid methyl ester Formula: C15H24N2O2S2 MolecularWeight: 328.49326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=C(C(=CS1)CC(C)C)C(=O)OC

Isomeric SMILES

CCCCNC(=S)NC1=C(C(=CS1)CC(C)C)C(=O)OC

InChI

InChI=1S/C15H24N2O2S2/c1-5-6-7-16-15(20)17-13-12(14(18)19-4)11(9-21-13)8-10(2)3/h9-10H,5-8H2,1-4H3,(H2,16,17,20)