N-[4-[4-(2,3,4,5-tetrahydro-1-benzoxepin-9-yl)piperazin-1-yl]butyl]-1H-benzimidazole-2-carboxamide

Systemtic Name: N-[4-[4-(2,3,4,5-tetrahydro-1-benzoxepin-9-yl)piperazin-1-yl]butyl]-1H-benzimidazole-2-carboxamide Openeye Name: N-[4-[4-(2,3,4,5-tetrahydro-1-benzoxepin-9-yl)piperazin-1-yl]butyl]-1H-benzimidazole-2-carboxamide CAS Name: N-[4-[4-(2,3,4,5-tetrahydro-1-benzoxepin-9-yl)-1-piperazinyl]butyl]-1H-benzimidazole-2-carboxamide IUPAC Name: N-[4-[4-(2,3,4,5-tetrahydro-1-benzoxepin-9-yl)piperazin-1-yl]butyl]-1H-benzimidazole-2-carboxamide Traditional Name: N-[4-[4-(2,3,4,5-tetrahydro-1-benzoxepin-9-yl)piperazino]butyl]-1H-benzimidazole-2-carboxamide Formula: C26H33N5O2 MolecularWeight: 447.57252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC2=C(C1)C=CC=C2N3CCN(CC3)CCCCNC(=O)C4=NC5=CC=CC=C5N4

Isomeric SMILES

C1CCOC2=C(C1)C=CC=C2N3CCN(CC3)CCCCNC(=O)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C26H33N5O2/c32-26(25-28-21-10-1-2-11-22(21)29-25)27-13-4-5-14-30-15-17-31(18-16-30)23-12-7-9-20-8-3-6-19-33-24(20)23/h1-2,7,9-12H,3-6,8,13-19H2,(H,27,32)(H,28,29)