methyl 2-[bis(2-methylpropyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[bis(2-methylpropyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-(diisobutylcarbamothioylamino)-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[bis(2-methylpropyl)amino]-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[bis(2-methylpropyl)carbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-(diisobutylthiocarbamoylamino)-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C17H28N2O2S2 MolecularWeight: 356.54642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)N(CC(C)C)CC(C)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)N(CC(C)C)CC(C)C)C

InChI

InChI=1S/C17H28N2O2S2/c1-10(2)8-19(9-11(3)4)17(22)18-15-14(16(20)21-7)12(5)13(6)23-15/h10-11H,8-9H2,1-7H3,(H,18,22)