3-[[1-(1H-benzimidazol-2-yl)-5-chloranyl-6-oxidanylidene-pyridazin-4-yl]-(2-cyanoethyl)amino]propanenitrile

Systemtic Name: 3-[[1-(1H-benzimidazol-2-yl)-5-chloranyl-6-oxidanylidene-pyridazin-4-yl]-(2-cyanoethyl)amino]propanenitrile Openeye Name: 3-[[1-(1H-benzimidazol-2-yl)-5-chloro-6-oxo-pyridazin-4-yl]-(2-cyanoethyl)amino]propanenitrile CAS Name: 3-[[1-(1H-benzimidazol-2-yl)-5-chloro-6-oxo-4-pyridazinyl]-(2-cyanoethyl)amino]propanenitrile IUPAC Name: 3-[[1-(1H-benzimidazol-2-yl)-5-chloro-6-oxopyridazin-4-yl]-(2-cyanoethyl)amino]propanenitrile Traditional Name: 3-[[1-(1H-benzimidazol-2-yl)-5-chloro-6-keto-pyridazin-4-yl]-(2-cyanoethyl)amino]propionitrile Formula: C17H14ClN7O MolecularWeight: 367.79236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)N3C(=O)C(=C(C=N3)N(CCC#N)CCC#N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)N3C(=O)C(=C(C=N3)N(CCC#N)CCC#N)Cl

InChI

InChI=1S/C17H14ClN7O/c18-15-14(24(9-3-7-19)10-4-8-20)11-21-25(16(15)26)17-22-12-5-1-2-6-13(12)23-17/h1-2,5-6,11H,3-4,9-10H2,(H,22,23)