(2S)-2-(1,3-benzothiazol-2-yl)-2-(6-chloranylpyridazin-3-yl)ethanenitrile

Systemtic Name: (2S)-2-(1,3-benzothiazol-2-yl)-2-(6-chloranylpyridazin-3-yl)ethanenitrile Openeye Name: (2S)-2-(1,3-benzothiazol-2-yl)-2-(6-chloropyridazin-3-yl)acetonitrile CAS Name: (2S)-2-(1,3-benzothiazol-2-yl)-2-(6-chloro-3-pyridazinyl)acetonitrile IUPAC Name: (2S)-2-(1,3-benzothiazol-2-yl)-2-(6-chloropyridazin-3-yl)acetonitrile Traditional Name: (2S)-2-(1,3-benzothiazol-2-yl)-2-(6-chloropyridazin-3-yl)acetonitrile Formula: C13H7ClN4S MolecularWeight: 286.73948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)[C@H](C#N)C3=NN=C(C=C3)Cl

InChI

InChI=1S/C13H7ClN4S/c14-12-6-5-9(17-18-12)8(7-15)13-16-10-3-1-2-4-11(10)19-13/h1-6,8H/t8-/m1/s1