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

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-N-(4-piperidin-1-ylphenyl)pyrazole-4-carboxamide Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-N-[4-(1-piperidyl)phenyl]pyrazole-4-carboxamide CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-N-[4-(1-piperidinyl)phenyl]-4-pyrazolecarboxamide IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-N-(4-piperidin-1-ylphenyl)pyrazole-4-carboxamide Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-methyl-N-(4-piperidinophenyl)pyrazole-4-carboxamide Formula: C25H28N4O3 MolecularWeight: 432.51482

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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)N5CCCCC5

Isomeric SMILES

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCCCO3)C(=O)NC4=CC=C(C=C4)N5CCCCC5

InChI

InChI=1S/C25H28N4O3/c1-28-17-21(24(27-28)18-6-11-22-23(16-18)32-15-5-14-31-22)25(30)26-19-7-9-20(10-8-19)29-12-3-2-4-13-29/h6-11,16-17H,2-5,12-15H2,1H3,(H,26,30)