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

Systemtic Name: methyl 5-methyl-2-[(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonylamino)carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-methyl-2-[(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)carbamothioylamino]thiophene-3-carboxylate CAS Name: 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 5-methyl-2-[(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonylamino)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-[(4,5,6,7-tetrahydrobenzothiophene-3-carbonylamino)thiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C17H19N3O3S3 MolecularWeight: 409.54606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=S)NNC(=O)C2=CSC3=C2CCCC3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=S)NNC(=O)C2=CSC3=C2CCCC3)C(=O)OC

InChI

InChI=1S/C17H19N3O3S3/c1-9-7-11(16(22)23-2)15(26-9)18-17(24)20-19-14(21)12-8-25-13-6-4-3-5-10(12)13/h7-8H,3-6H2,1-2H3,(H,19,21)(H2,18,20,24)