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

Systemtic Name: 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]butyl]benzimidazole-5-carboxamide Openeye Name: 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]butyl]benzimidazole-5-carboxamide CAS Name: 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-piperazinyl]butyl]-5-benzimidazolecarboxamide IUPAC Name: 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]butyl]benzimidazole-5-carboxamide Traditional Name: 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazino]butyl]benzimidazole-5-carboxamide Formula: C24H29N5O3 MolecularWeight: 435.51876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N5O3/c25-24(30)18-3-5-21-20(15-18)26-17-29(21)8-2-1-7-27-9-11-28(12-10-27)19-4-6-22-23(16-19)32-14-13-31-22/h3-6,15-17H,1-2,7-14H2,(H2,25,30)