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

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-2-[2,6-dimethyl-1-(pyridin-4-ylmethyl)pyridin-4-ylidene]ethanenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-2-[2,6-dimethyl-1-(4-pyridylmethyl)-4-pyridylidene]acetonitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-2-[2,6-dimethyl-1-(pyridin-4-ylmethyl)-4-pyridinylidene]acetonitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-2-[2,6-dimethyl-1-(pyridin-4-ylmethyl)pyridin-4-ylidene]acetonitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-2-[2,6-dimethyl-1-(4-pyridylmethyl)-4-pyridylidene]acetonitrile Formula: C22H18N4S MolecularWeight: 370.47012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C#N)C2=NC3=CC=CC=C3S2)C=C(N1CC4=CC=NC=C4)C

Isomeric SMILES

CC1=CC(=C(C#N)C2=NC3=CC=CC=C3S2)C=C(N1CC4=CC=NC=C4)C

InChI

InChI=1S/C22H18N4S/c1-15-11-18(12-16(2)26(15)14-17-7-9-24-10-8-17)19(13-23)22-25-20-5-3-4-6-21(20)27-22/h3-12H,14H2,1-2H3