5-chloranyl-N-[(2,4-dimethoxyphenyl)methyl]-3-methyl-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-[(2,4-dimethoxyphenyl)methyl]-3-methyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-N-[(2,4-dimethoxyphenyl)methyl]-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[(2,4-dimethoxyphenyl)methyl]-3-methyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-N-[(2,4-dimethoxyphenyl)methyl]-3-methylpyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-N-(2,4-dimethoxybenzyl)-3-methyl-pyrazole-4-carboxamide Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC2=C(C=C(C=C2)OC)OC)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCC2=C(C=C(C=C2)OC)OC)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C21H22ClN3O3/c1-14-19(20(22)25(24-14)13-15-7-5-4-6-8-15)21(26)23-12-16-9-10-17(27-2)11-18(16)28-3/h4-11H,12-13H2,1-3H3,(H,23,26)