3-(1,3-benzodioxol-5-yl)-N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-1H-pyrazole-5-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-1H-pyrazole-5-carboxamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[1-[(2-chlorophenyl)methyl]-4-pyrazolyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]-1H-pyrazole-5-carboxamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[1-(2-chlorobenzyl)pyrazol-4-yl]-1H-pyrazole-5-carboxamide Formula: C21H16ClN5O3 MolecularWeight: 421.83644

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NNC(=C3)C(=O)NC4=CN(N=C4)CC5=CC=CC=C5Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NNC(=C3)C(=O)NC4=CN(N=C4)CC5=CC=CC=C5Cl

InChI

InChI=1S/C21H16ClN5O3/c22-16-4-2-1-3-14(16)10-27-11-15(9-23-27)24-21(28)18-8-17(25-26-18)13-5-6-19-20(7-13)30-12-29-19/h1-9,11H,10,12H2,(H,24,28)(H,25,26)