methyl 2-[[(4-ethyl-5-methyl-thiophen-3-yl)carbonylamino]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(4-ethyl-5-methyl-thiophen-3-yl)carbonylamino]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[(4-ethyl-5-methyl-thiophene-3-carbonyl)amino]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[[(4-ethyl-5-methyl-3-thiophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4-ethyl-5-methylthiophene-3-carbonyl)amino]carbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[(4-ethyl-5-methyl-thiophene-3-carbonyl)amino]thiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C17H21N3O3S3 MolecularWeight: 411.56194

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC=C1C(=O)NNC(=S)NC2=C(C(=C(S2)C)C)C(=O)OC)C

Isomeric SMILES

CCC1=C(SC=C1C(=O)NNC(=S)NC2=C(C(=C(S2)C)C)C(=O)OC)C

InChI

InChI=1S/C17H21N3O3S3/c1-6-11-10(4)25-7-12(11)14(21)19-20-17(24)18-15-13(16(22)23-5)8(2)9(3)26-15/h7H,6H2,1-5H3,(H,19,21)(H2,18,20,24)