3-(1,3-benzothiazol-2-yl)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(1,3-benzothiazol-2-yl)-3-oxo-propanenitrile CAS Name: 3-(1,3-benzothiazol-2-yl)-3-oxopropanenitrile IUPAC Name: 3-(1,3-benzothiazol-2-yl)-3-oxopropanenitrile Traditional Name: 3-(1,3-benzothiazol-2-yl)-3-keto-propionitrile Formula: C10H6N2OS MolecularWeight: 202.23244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(=O)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C(=O)CC#N

InChI

InChI=1S/C10H6N2OS/c11-6-5-8(13)10-12-7-3-1-2-4-9(7)14-10/h1-4H,5H2