2-(1,3-benzothiazol-2-yl)-2-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)ethanenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-2-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)ethanenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-2-(5-chloro-6-oxo-1-phenyl-pyridazin-4-yl)acetonitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-2-(5-chloro-6-oxo-1-phenyl-4-pyridazinyl)acetonitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-2-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)acetonitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-2-(5-chloro-6-keto-1-phenyl-pyridazin-4-yl)acetonitrile Formula: C19H11ClN4OS MolecularWeight: 378.83484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=C(C=N2)C(C#N)C3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(=C(C=N2)C(C#N)C3=NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C19H11ClN4OS/c20-17-14(11-22-24(19(17)25)12-6-2-1-3-7-12)13(10-21)18-23-15-8-4-5-9-16(15)26-18/h1-9,11,13H