1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]butyl]benzimidazole-5-carbonitrile

Systemtic Name: 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]butyl]benzimidazole-5-carbonitrile Openeye Name: 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]butyl]benzimidazole-5-carbonitrile CAS Name: 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-piperazinyl]butyl]-5-benzimidazolecarbonitrile IUPAC Name: 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]butyl]benzimidazole-5-carbonitrile Traditional Name: 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazino]butyl]benzimidazole-5-carbonitrile Formula: C24H27N5O2 MolecularWeight: 417.50348

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C=NC3=C2C=CC(=C3)C#N)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CN(CCN1CCCCN2C=NC3=C2C=CC(=C3)C#N)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C24H27N5O2/c25-17-19-3-5-22-21(15-19)26-18-29(22)8-2-1-7-27-9-11-28(12-10-27)20-4-6-23-24(16-20)31-14-13-30-23/h3-6,15-16,18H,1-2,7-14H2