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

Systemtic Name: N-(2-methoxyphenyl)-3-[4-(2-methylpropoxy)phenyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(4-isobutoxyphenyl)-N-(2-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: N-(2-methoxyphenyl)-3-[4-(2-methylpropoxy)phenyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(2-methoxyphenyl)-3-[4-(2-methylpropoxy)phenyl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(4-isobutoxyphenyl)-N-(2-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=CC=CC=C3OC)C4=CC=CC=C4

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=CC=CC=C3OC)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O3/c1-19(2)18-33-22-15-13-20(14-16-22)26-23(17-30(29-26)21-9-5-4-6-10-21)27(31)28-24-11-7-8-12-25(24)32-3/h4-17,19H,18H2,1-3H3,(H,28,31)