2-[3-[4-(benzimidazol-1-yl)butylamino]-2-oxidanyl-propoxy]pyridine-3-carbonitrile

Systemtic Name: 2-[3-[4-(benzimidazol-1-yl)butylamino]-2-oxidanyl-propoxy]pyridine-3-carbonitrile Openeye Name: 2-[3-[4-(benzimidazol-1-yl)butylamino]-2-hydroxy-propoxy]pyridine-3-carbonitrile CAS Name: 2-[3-[4-(1-benzimidazolyl)butylamino]-2-hydroxypropoxy]-3-pyridinecarbonitrile IUPAC Name: 2-[3-[4-(benzimidazol-1-yl)butylamino]-2-hydroxypropoxy]pyridine-3-carbonitrile Traditional Name: 2-[3-[4-(benzimidazol-1-yl)butylamino]-2-hydroxy-propoxy]nicotinonitrile Formula: C20H23N5O2 MolecularWeight: 365.42892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CCCCNCC(COC3=C(C=CC=N3)C#N)O

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CCCCNCC(COC3=C(C=CC=N3)C#N)O

InChI

InChI=1S/C20H23N5O2/c21-12-16-6-5-10-23-20(16)27-14-17(26)13-22-9-3-4-11-25-15-24-18-7-1-2-8-19(18)25/h1-2,5-8,10,15,17,22,26H,3-4,9,11,13-14H2