3-azanyl-4-[2-(hydroxymethyl)phenyl]sulfanyl-benzenecarbonitrile

Systemtic Name: 3-azanyl-4-[2-(hydroxymethyl)phenyl]sulfanyl-benzenecarbonitrile Openeye Name: 3-amino-4-[2-(hydroxymethyl)phenyl]sulfanyl-benzonitrile CAS Name: 3-amino-4-[[2-(hydroxymethyl)phenyl]thio]benzonitrile IUPAC Name: 3-amino-4-[2-(hydroxymethyl)phenyl]sulfanylbenzonitrile Traditional Name: 3-amino-4-[(2-methylolphenyl)thio]benzonitrile Formula: C14H12N2OS MolecularWeight: 256.32288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CO)SC2=C(C=C(C=C2)C#N)N

Isomeric SMILES

C1=CC=C(C(=C1)CO)SC2=C(C=C(C=C2)C#N)N

InChI

InChI=1S/C14H12N2OS/c15-8-10-5-6-14(12(16)7-10)18-13-4-2-1-3-11(13)9-17/h1-7,17H,9,16H2