2-[(2-carbamothioylhydrazinyl)-phenyl-methyl]sulfanylethanoic acid

Systemtic Name: 2-[(2-carbamothioylhydrazinyl)-phenyl-methyl]sulfanylethanoic acid Openeye Name: 2-[(2-carbamothioylhydrazino)-phenyl-methyl]sulfanylacetic acid CAS Name: 2-[[(carbamothioylhydrazo)-phenylmethyl]thio]acetic acid IUPAC Name: 2-[(2-carbamothioylhydrazinyl)-phenylmethyl]sulfanylacetic acid Traditional Name: 2-[[phenyl-(N'-thiocarbamoylhydrazino)methyl]thio]acetic acid Formula: C10H13N3O2S2 MolecularWeight: 271.35912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(NNC(=S)N)SCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(NNC(=S)N)SCC(=O)O

InChI

InChI=1S/C10H13N3O2S2/c11-10(16)13-12-9(17-6-8(14)15)7-4-2-1-3-5-7/h1-5,9,12H,6H2,(H,14,15)(H3,11,13,16)