3-(3-methoxyphenyl)-N-[3-(2-methylpropoxy)propyl]-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 3-(3-methoxyphenyl)-N-[3-(2-methylpropoxy)propyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(3-isobutoxypropyl)-3-(3-methoxyphenyl)pyrazole-4-carboxamide CAS Name: 3-(3-methoxyphenyl)-N-[3-(2-methylpropoxy)propyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-3-(3-methoxyphenyl)-N-[3-(2-methylpropoxy)propyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(3-isobutoxypropyl)-3-(3-methoxyphenyl)pyrazole-4-carboxamide Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCCCNC(=O)C1=CN(N=C1C2=CC(=CC=C2)OC)CC3=CC=CC=C3

Isomeric SMILES

CC(C)COCCCNC(=O)C1=CN(N=C1C2=CC(=CC=C2)OC)CC3=CC=CC=C3

InChI

InChI=1S/C25H31N3O3/c1-19(2)18-31-14-8-13-26-25(29)23-17-28(16-20-9-5-4-6-10-20)27-24(23)21-11-7-12-22(15-21)30-3/h4-7,9-12,15,17,19H,8,13-14,16,18H2,1-3H3,(H,26,29)