methyl 4-ethyl-5-methyl-2-[(2-thiophen-2-ylethanoylamino)carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-ethyl-5-methyl-2-[(2-thiophen-2-ylethanoylamino)carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 4-ethyl-5-methyl-2-[[[2-(2-thienyl)acetyl]amino]carbamothioylamino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[[(1-oxo-2-thiophen-2-ylethyl)hydrazo]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-ethyl-5-methyl-2-[[(2-thiophen-2-ylacetyl)amino]carbamothioylamino]thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-[[[2-(2-thienyl)acetyl]amino]thiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C16H19N3O3S3 MolecularWeight: 397.53536

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC)NC(=S)NNC(=O)CC2=CC=CS2)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC)NC(=S)NNC(=O)CC2=CC=CS2)C

InChI

InChI=1S/C16H19N3O3S3/c1-4-11-9(2)25-14(13(11)15(21)22-3)17-16(23)19-18-12(20)8-10-6-5-7-24-10/h5-7H,4,8H2,1-3H3,(H,18,20)(H2,17,19,23)