N-[4-(1H-benzimidazol-2-yl)phenyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-pyrazole-4-carboxamide

Systemtic Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-pyrazole-4-carboxamide Openeye Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-pyrazole-4-carboxamide CAS Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-4-pyrazolecarboxamide IUPAC Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methylpyrazole-4-carboxamide Traditional Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-pyrazole-4-carboxamide Formula: C27H23N5O3 MolecularWeight: 465.50322

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCCCO3)C(=O)NC4=CC=C(C=C4)C5=NC6=CC=CC=C6N5

Isomeric SMILES

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCCCO3)C(=O)NC4=CC=C(C=C4)C5=NC6=CC=CC=C6N5

InChI

InChI=1S/C27H23N5O3/c1-32-16-20(25(31-32)18-9-12-23-24(15-18)35-14-4-13-34-23)27(33)28-19-10-7-17(8-11-19)26-29-21-5-2-3-6-22(21)30-26/h2-3,5-12,15-16H,4,13-14H2,1H3,(H,28,33)(H,29,30)