3-azanyl-2-(4-ethynylphenyl)benzenethiol

Systemtic Name: 3-azanyl-2-(4-ethynylphenyl)benzenethiol Openeye Name: 3-amino-2-(4-ethynylphenyl)benzenethiol CAS Name: 3-amino-2-(4-ethynylphenyl)benzenethiol IUPAC Name: 3-amino-2-(4-ethynylphenyl)benzenethiol Traditional Name: 3-amino-2-(4-ethynylphenyl)benzenethiol Formula: C14H11NS MolecularWeight: 225.30884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC=C(C=C1)C2=C(C=CC=C2S)N

Isomeric SMILES

C#CC1=CC=C(C=C1)C2=C(C=CC=C2S)N

InChI

InChI=1S/C14H11NS/c1-2-10-6-8-11(9-7-10)14-12(15)4-3-5-13(14)16/h1,3-9,16H,15H2