2-(2,4-dimethoxy-1,3-benzothiazol-7-yl)ethanenitrile

Systemtic Name: 2-(2,4-dimethoxy-1,3-benzothiazol-7-yl)ethanenitrile Openeye Name: 2-(2,4-dimethoxy-1,3-benzothiazol-7-yl)acetonitrile CAS Name: 2-(2,4-dimethoxy-1,3-benzothiazol-7-yl)acetonitrile IUPAC Name: 2-(2,4-dimethoxy-1,3-benzothiazol-7-yl)acetonitrile Traditional Name: 2-(2,4-dimethoxy-1,3-benzothiazol-7-yl)acetonitrile Formula: C11H10N2O2S MolecularWeight: 234.2743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)CC#N)SC(=N2)OC

Isomeric SMILES

COC1=C2C(=C(C=C1)CC#N)SC(=N2)OC

InChI

InChI=1S/C11H10N2O2S/c1-14-8-4-3-7(5-6-12)10-9(8)13-11(15-2)16-10/h3-4H,5H2,1-2H3