3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(1-ethylbenzimidazol-2-yl)-1-methyl-pyrazole-4-carboxamide

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(1-ethylbenzimidazol-2-yl)-1-methyl-pyrazole-4-carboxamide Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(1-ethylbenzimidazol-2-yl)-1-methyl-pyrazole-4-carboxamide CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(1-ethyl-2-benzimidazolyl)-1-methyl-4-pyrazolecarboxamide IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(1-ethylbenzimidazol-2-yl)-1-methylpyrazole-4-carboxamide Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(1-ethylbenzimidazol-2-yl)-1-methyl-pyrazole-4-carboxamide Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1NC(=O)C3=CN(N=C3C4=CC5=C(C=C4)OCCCO5)C

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1NC(=O)C3=CN(N=C3C4=CC5=C(C=C4)OCCCO5)C

InChI

InChI=1S/C23H23N5O3/c1-3-28-18-8-5-4-7-17(18)24-23(28)25-22(29)16-14-27(2)26-21(16)15-9-10-19-20(13-15)31-12-6-11-30-19/h4-5,7-10,13-14H,3,6,11-12H2,1-2H3,(H,24,25,29)