methyl 2-[di(butan-2-yl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[di(butan-2-yl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-(disec-butylcarbamothioylamino)-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[di(butan-2-yl)amino]-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[di(butan-2-yl)carbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-(disec-butylthiocarbamoylamino)-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C17H28N2O2S2 MolecularWeight: 356.54642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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