6-[3-chloranyl-4-(4-methylpiperazin-1-yl)phenyl]-2-oxidanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 6-[3-chloranyl-4-(4-methylpiperazin-1-yl)phenyl]-2-oxidanylidene-1H-pyridine-3-carbonitrile Openeye Name: 6-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-2-oxo-1H-pyridine-3-carbonitrile CAS Name: 6-[3-chloro-4-(4-methyl-1-piperazinyl)phenyl]-2-oxo-1H-pyridine-3-carbonitrile IUPAC Name: 6-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-2-oxo-1H-pyridine-3-carbonitrile Traditional Name: 6-[3-chloro-4-(4-methylpiperazino)phenyl]-2-keto-1H-pyridine-3-carbonitrile Formula: C17H17ClN4O MolecularWeight: 328.79608

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C3=CC=C(C(=O)N3)C#N)Cl

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C3=CC=C(C(=O)N3)C#N)Cl

InChI

InChI=1S/C17H17ClN4O/c1-21-6-8-22(9-7-21)16-5-3-12(10-14(16)18)15-4-2-13(11-19)17(23)20-15/h2-5,10H,6-9H2,1H3,(H,20,23)