(2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-2-pyrimidin-4-yl-ethanenitrile

Systemtic Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-2-pyrimidin-4-yl-ethanenitrile Openeye Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-2-pyrimidin-4-yl-acetonitrile CAS Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-2-(4-pyrimidinyl)acetonitrile IUPAC Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-2-pyrimidin-4-ylacetonitrile Traditional Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-2-(4-pyrimidyl)acetonitrile Formula: C13H8N4S MolecularWeight: 252.29442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C3=NC=NC=C3)S2

Isomeric SMILES

C1=CC=C2C(=C1)N/C(=C(/C#N)\C3=NC=NC=C3)/S2

InChI

InChI=1S/C13H8N4S/c14-7-9(10-5-6-15-8-16-10)13-17-11-3-1-2-4-12(11)18-13/h1-6,8,17H/b13-9+