methyl 4-ethyl-5-methyl-2-[(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-ethyl-5-methyl-2-[(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 4-ethyl-5-methyl-2-[(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)carbamothioylamino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]hydrazo]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-ethyl-5-methyl-2-[(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonylamino)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-[(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)thiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C19H23N3O3S3 MolecularWeight: 437.59922

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC)NC(=S)NNC(=O)C2=CSC3=C2CCCC3)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC)NC(=S)NNC(=O)C2=CSC3=C2CCCC3)C

InChI

InChI=1S/C19H23N3O3S3/c1-4-11-10(2)28-17(15(11)18(24)25-3)20-19(26)22-21-16(23)13-9-27-14-8-6-5-7-12(13)14/h9H,4-8H2,1-3H3,(H,21,23)(H2,20,22,26)