2-(1,3-benzothiazol-2-yl)-2-(2-diazanylpyrimidin-4-yl)ethanenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-2-(2-diazanylpyrimidin-4-yl)ethanenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-2-(2-hydrazinopyrimidin-4-yl)acetonitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-2-(2-hydrazinyl-4-pyrimidinyl)acetonitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-2-(2-hydrazinylpyrimidin-4-yl)acetonitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-2-(2-hydrazinopyrimidin-4-yl)acetonitrile Formula: C13H10N6S MolecularWeight: 282.3237

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N6S/c14-7-8(9-5-6-16-13(18-9)19-15)12-17-10-3-1-2-4-11(10)20-12/h1-6,8H,15H2,(H,16,18,19)