methyl 2-[[(4-tert-butylphenyl)sulfonylamino]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[(4-tert-butylphenyl)sulfonylamino]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[(4-tert-butylphenyl)sulfonylamino]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[(4-tert-butylphenyl)sulfonylhydrazo]-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4-tert-butylphenyl)sulfonylamino]carbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[(4-tert-butylphenyl)sulfonylamino]thiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C19H25N3O4S3 MolecularWeight: 455.6145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NNS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NNS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C)C

InChI

InChI=1S/C19H25N3O4S3/c1-11-12(2)28-16(15(11)17(23)26-6)20-18(27)21-22-29(24,25)14-9-7-13(8-10-14)19(3,4)5/h7-10,22H,1-6H3,(H2,20,21,27)