2-(2-azanyl-1,3-benzothiazol-6-yl)ethanenitrile; methane

Systemtic Name: 2-(2-azanyl-1,3-benzothiazol-6-yl)ethanenitrile; methane Openeye Name: 2-(2-amino-1,3-benzothiazol-6-yl)acetonitrile; methane CAS Name: 2-(2-amino-1,3-benzothiazol-6-yl)acetonitrile; methane IUPAC Name: 2-(2-amino-1,3-benzothiazol-6-yl)acetonitrile; methane Traditional Name: 2-(2-amino-1,3-benzothiazol-6-yl)acetonitrile; methane Formula: C10H11N3S MolecularWeight: 205.27944

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Descriptors Computed from Structure

Canonical SMILES:

C.C1=CC2=C(C=C1CC#N)SC(=N2)N

Isomeric SMILES

C.C1=CC2=C(C=C1CC#N)SC(=N2)N

InChI

InChI=1S/C9H7N3S.CH4/c10-4-3-6-1-2-7-8(5-6)13-9(11)12-7;/h1-2,5H,3H2,(H2,11,12);1H4