2-[(Z)-N-(carbamothioylamino)-C-methyl-carbonimidoyl]benzoic acid

Systemtic Name: 2-[(Z)-N-(carbamothioylamino)-C-methyl-carbonimidoyl]benzoic acid Openeye Name: 2-[(Z)-N-(carbamothioylamino)-C-methyl-carbonimidoyl]benzoic acid CAS Name: 2-[(1Z)-1-(carbamothioylhydrazinylidene)ethyl]benzoic acid IUPAC Name: 2-[(Z)-N-(carbamothioylamino)-C-methylcarbonimidoyl]benzoic acid Traditional Name: 2-[(Z)-C-methyl-N-thioureido-carbonimidoyl]benzoic acid Formula: C10H11N3O2S MolecularWeight: 237.27824

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)N)C1=CC=CC=C1C(=O)O

Isomeric SMILES

C/C(=N/NC(=S)N)/C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C10H11N3O2S/c1-6(12-13-10(11)16)7-4-2-3-5-8(7)9(14)15/h2-5H,1H3,(H,14,15)(H3,11,13,16)/b12-6-