2-[1-(1,3-benzodioxol-5-yl)-2,6-dimethyl-pyridin-4-ylidene]-2-(1,3-benzothiazol-2-yl)ethanenitrile

Systemtic Name: 2-[1-(1,3-benzodioxol-5-yl)-2,6-dimethyl-pyridin-4-ylidene]-2-(1,3-benzothiazol-2-yl)ethanenitrile Openeye Name: 2-[1-(1,3-benzodioxol-5-yl)-2,6-dimethyl-4-pyridylidene]-2-(1,3-benzothiazol-2-yl)acetonitrile CAS Name: 2-[1-(1,3-benzodioxol-5-yl)-2,6-dimethyl-4-pyridinylidene]-2-(1,3-benzothiazol-2-yl)acetonitrile IUPAC Name: 2-[1-(1,3-benzodioxol-5-yl)-2,6-dimethylpyridin-4-ylidene]-2-(1,3-benzothiazol-2-yl)acetonitrile Traditional Name: 2-[1-(1,3-benzodioxol-5-yl)-2,6-dimethyl-4-pyridylidene]-2-(1,3-benzothiazol-2-yl)acetonitrile Formula: C23H17N3O2S MolecularWeight: 399.46498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C#N)C2=NC3=CC=CC=C3S2)C=C(N1C4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CC1=CC(=C(C#N)C2=NC3=CC=CC=C3S2)C=C(N1C4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C23H17N3O2S/c1-14-9-16(18(12-24)23-25-19-5-3-4-6-22(19)29-23)10-15(2)26(14)17-7-8-20-21(11-17)28-13-27-20/h3-11H,13H2,1-2H3