N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-ethyl-1-(4-fluorophenyl)pyrazole-4-carboxamide

Systemtic Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-ethyl-1-(4-fluorophenyl)pyrazole-4-carboxamide Openeye Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-ethyl-1-(4-fluorophenyl)pyrazole-4-carboxamide CAS Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-ethyl-1-(4-fluorophenyl)-4-pyrazolecarboxamide IUPAC Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-ethyl-1-(4-fluorophenyl)pyrazole-4-carboxamide Traditional Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-5-ethyl-1-(4-fluorophenyl)pyrazole-4-carboxamide Formula: C23H24FN3O3 MolecularWeight: 409.453363

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NC(C)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CCC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NC(C)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C23H24FN3O3/c1-3-20-19(14-25-27(20)18-8-6-17(24)7-9-18)23(28)26-15(2)16-5-10-21-22(13-16)30-12-4-11-29-21/h5-10,13-15H,3-4,11-12H2,1-2H3,(H,26,28)