N-(1,3-benzodioxol-5-ylmethyl)-5-(4-chloranyl-3-methyl-phenyl)-1-[(4-methylphenyl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(4-chloranyl-3-methyl-phenyl)-1-[(4-methylphenyl)methyl]pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(4-chloro-3-methyl-phenyl)-1-(p-tolylmethyl)pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(4-chloro-3-methylphenyl)-1-[(4-methylphenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(4-chloro-3-methylphenyl)-1-[(4-methylphenyl)methyl]pyrazole-3-carboxamide Traditional Name: 5-(4-chloro-3-methyl-phenyl)-1-(4-methylbenzyl)-N-piperonyl-pyrazole-3-carboxamide Formula: C27H24ClN3O3 MolecularWeight: 473.95076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=CC(=N2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC(=C(C=C5)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=CC(=N2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC(=C(C=C5)Cl)C

InChI

InChI=1S/C27H24ClN3O3/c1-17-3-5-19(6-4-17)15-31-24(21-8-9-22(28)18(2)11-21)13-23(30-31)27(32)29-14-20-7-10-25-26(12-20)34-16-33-25/h3-13H,14-16H2,1-2H3,(H,29,32)