ethyl 4-[[azanyl-(phenylmethylsulfanyl)methylidene]amino]benzoate hydrochloride

Systemtic Name: ethyl 4-[[azanyl-(phenylmethylsulfanyl)methylidene]amino]benzoate hydrochloride Openeye Name: ethyl 4-[[amino(benzylsulfanyl)methylene]amino]benzoate hydrochloride CAS Name: 4-[[amino-(phenylmethylthio)methylidene]amino]benzoic acid ethyl ester hydrochloride IUPAC Name: ethyl 4-[[amino(benzylsulfanyl)methylidene]amino]benzoate hydrochloride Traditional Name: 4-[[amino-(benzylthio)methylene]amino]benzoic acid ethyl ester hydrochloride Formula: C17H19ClN2O2S MolecularWeight: 350.86296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=C(N)SCC2=CC=CC=C2.Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=C(N)SCC2=CC=CC=C2.Cl

InChI

InChI=1S/C17H18N2O2S.ClH/c1-2-21-16(20)14-8-10-15(11-9-14)19-17(18)22-12-13-6-4-3-5-7-13;/h3-11H,2,12H2,1H3,(H2,18,19);1H