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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CS1)C(=O)NNC(=S)NC2=C(C(=C(S2)C)CC)C(=O)OC

Isomeric SMILES

CCC1=CC(=CS1)C(=O)NNC(=S)NC2=C(C(=C(S2)C)CC)C(=O)OC

InChI

InChI=1S/C17H21N3O3S3/c1-5-11-7-10(8-25-11)14(21)19-20-17(24)18-15-13(16(22)23-4)12(6-2)9(3)26-15/h7-8H,5-6H2,1-4H3,(H,19,21)(H2,18,20,24)