5-[(Z)-N-[(2,4-dimethylphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[(Z)-N-[(2,4-dimethylphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]thiophene-2-carboxylic acid Openeye Name: 5-[(Z)-N-[(2,4-dimethylphenyl)carbamothioylamino]-C-methyl-carbonimidoyl]thiophene-2-carboxylic acid CAS Name: 5-[(1Z)-1-[[(2,4-dimethylanilino)-sulfanylidenemethyl]hydrazinylidene]ethyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[(Z)-N-[(2,4-dimethylphenyl)carbamothioylamino]-C-methylcarbonimidoyl]thiophene-2-carboxylic acid Traditional Name: 5-[(Z)-N-[(2,4-dimethylphenyl)thiocarbamoylamino]-C-methyl-carbonimidoyl]-2-thenoic acid Formula: C16H17N3O2S2 MolecularWeight: 347.45508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NN=C(C)C2=CC=C(S2)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N/N=C(/C)\C2=CC=C(S2)C(=O)O)C

InChI

InChI=1S/C16H17N3O2S2/c1-9-4-5-12(10(2)8-9)17-16(22)19-18-11(3)13-6-7-14(23-13)15(20)21/h4-8H,1-3H3,(H,20,21)(H2,17,19,22)/b18-11-