2-(2-oxidanylidene-3-piperazin-1-yl-1-propyl-benzimidazol-4-yl)pyridine-4-carbonitrile

Systemtic Name: 2-(2-oxidanylidene-3-piperazin-1-yl-1-propyl-benzimidazol-4-yl)pyridine-4-carbonitrile Openeye Name: 2-(2-oxo-3-piperazin-1-yl-1-propyl-benzimidazol-4-yl)pyridine-4-carbonitrile CAS Name: 2-[2-oxo-3-(1-piperazinyl)-1-propyl-4-benzimidazolyl]-4-pyridinecarbonitrile IUPAC Name: 2-(2-oxo-3-piperazin-1-yl-1-propylbenzimidazol-4-yl)pyridine-4-carbonitrile Traditional Name: 2-(2-keto-3-piperazino-1-propyl-benzimidazol-4-yl)isonicotinonitrile Formula: C20H22N6O MolecularWeight: 362.42828

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC(=C2N(C1=O)N3CCNCC3)C4=NC=CC(=C4)C#N

Isomeric SMILES

CCCN1C2=CC=CC(=C2N(C1=O)N3CCNCC3)C4=NC=CC(=C4)C#N

InChI

InChI=1S/C20H22N6O/c1-2-10-25-18-5-3-4-16(17-13-15(14-21)6-7-23-17)19(18)26(20(25)27)24-11-8-22-9-12-24/h3-7,13,22H,2,8-12H2,1H3