(2E)-3-phenyl-2-[(phenylmethyl)carbamothioylhydrazinylidene]propanoic acid

Systemtic Name: (2E)-3-phenyl-2-[(phenylmethyl)carbamothioylhydrazinylidene]propanoic acid Openeye Name: (2E)-2-(benzylcarbamothioylhydrazono)-3-phenyl-propanoic acid CAS Name: (2E)-3-phenyl-2-[[[(phenylmethyl)amino]-sulfanylidenemethyl]hydrazinylidene]propanoic acid IUPAC Name: (2E)-2-(benzylcarbamothioylhydrazinylidene)-3-phenylpropanoic acid Traditional Name: (2E)-2-(benzylthiocarbamoylhydrazono)-3-phenyl-propionic acid Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=NNC(=S)NCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C/C(=N\NC(=S)NCC2=CC=CC=C2)/C(=O)O

InChI

InChI=1S/C17H17N3O2S/c21-16(22)15(11-13-7-3-1-4-8-13)19-20-17(23)18-12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H,21,22)(H2,18,20,23)/b19-15+