3-(4-bromophenyl)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-N-ethyl-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-bromophenyl)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxidanylidene-ethyl]-N-ethyl-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-bromophenyl)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-ethyl]-N-ethyl-1H-pyrazole-5-carboxamide CAS Name: 3-(4-bromophenyl)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-N-ethyl-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-bromophenyl)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-N-ethyl-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-bromophenyl)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-keto-ethyl]-N-ethyl-1H-pyrazole-5-carboxamide Formula: C22H21BrN4O4 MolecularWeight: 485.33054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC(=NN3)C4=CC=C(C=C4)Br

Isomeric SMILES

CCN(CC(=O)NC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC(=NN3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H21BrN4O4/c1-2-27(13-21(28)24-16-7-8-19-20(11-16)31-10-9-30-19)22(29)18-12-17(25-26-18)14-3-5-15(23)6-4-14/h3-8,11-12H,2,9-10,13H2,1H3,(H,24,28)(H,25,26)