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

Systemtic Name: methyl 5-ethyl-2-[[(5-ethylthiophen-2-yl)carbonylamino]carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-ethyl-2-[[(5-ethylthiophene-2-carbonyl)amino]carbamothioylamino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[[[(5-ethyl-2-thiophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-ethyl-2-[[(5-ethylthiophene-2-carbonyl)amino]carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[(5-ethylthiophene-2-carbonyl)amino]thiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C16H19N3O3S3 MolecularWeight: 397.53536

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(=O)NNC(=S)NC2=C(C=C(S2)CC)C(=O)OC

Isomeric SMILES

CCC1=CC=C(S1)C(=O)NNC(=S)NC2=C(C=C(S2)CC)C(=O)OC

InChI

InChI=1S/C16H19N3O3S3/c1-4-9-6-7-12(24-9)13(20)18-19-16(23)17-14-11(15(21)22-3)8-10(5-2)25-14/h6-8H,4-5H2,1-3H3,(H,18,20)(H2,17,19,23)