[(E)-[azanyl(phenyl)methylidene]amino] 3-(phenylmethylsulfanyl)propanoate

Systemtic Name: [(E)-[azanyl(phenyl)methylidene]amino] 3-(phenylmethylsulfanyl)propanoate Openeye Name: [(E)-[amino(phenyl)methylene]amino] 3-benzylsulfanylpropanoate CAS Name: 3-(phenylmethylthio)propanoic acid [(E)-[amino(phenyl)methylidene]amino] ester IUPAC Name: [(E)-[amino(phenyl)methylidene]amino] 3-benzylsulfanylpropanoate Traditional Name: 3-(benzylthio)propionic acid [(E)-[amino(phenyl)methylene]amino] ester Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCC(=O)ON=C(C2=CC=CC=C2)N

Isomeric SMILES

C1=CC=C(C=C1)CSCCC(=O)O/N=C(\C2=CC=CC=C2)/N

InChI

InChI=1S/C17H18N2O2S/c18-17(15-9-5-2-6-10-15)19-21-16(20)11-12-22-13-14-7-3-1-4-8-14/h1-10H,11-13H2,(H2,18,19)