5-chloranyl-N-heptan-2-yl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-heptan-2-yl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Openeye Name: 5-chloro-3-methyl-N-(1-methylhexyl)-1-(p-tolylmethyl)pyrazole-4-carboxamide CAS Name: 5-chloro-N-heptan-2-yl-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-heptan-2-yl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Traditional Name: 5-chloro-3-methyl-1-(4-methylbenzyl)-N-(1-methylhexyl)pyrazole-4-carboxamide Formula: C20H28ClN3O MolecularWeight: 361.90882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C1=C(N(N=C1C)CC2=CC=C(C=C2)C)Cl

Isomeric SMILES

CCCCCC(C)NC(=O)C1=C(N(N=C1C)CC2=CC=C(C=C2)C)Cl

InChI

InChI=1S/C20H28ClN3O/c1-5-6-7-8-15(3)22-20(25)18-16(4)23-24(19(18)21)13-17-11-9-14(2)10-12-17/h9-12,15H,5-8,13H2,1-4H3,(H,22,25)