5-azanyl-2-(3-oxidanylpropylsulfanyl)benzenecarbonitrile

Systemtic Name: 5-azanyl-2-(3-oxidanylpropylsulfanyl)benzenecarbonitrile Openeye Name: 5-amino-2-(3-hydroxypropylsulfanyl)benzonitrile CAS Name: 5-amino-2-(3-hydroxypropylthio)benzonitrile IUPAC Name: 5-amino-2-(3-hydroxypropylsulfanyl)benzonitrile Traditional Name: 5-amino-2-(3-hydroxypropylthio)benzonitrile Formula: C10H12N2OS MolecularWeight: 208.28008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)C#N)SCCCO

Isomeric SMILES

C1=CC(=C(C=C1N)C#N)SCCCO

InChI

InChI=1S/C10H12N2OS/c11-7-8-6-9(12)2-3-10(8)14-5-1-4-13/h2-3,6,13H,1,4-5,12H2