N-(4-butoxyphenyl)-4-(3-methyl-5-phenyl-pyrazol-1-yl)benzamide

Systemtic Name: N-(4-butoxyphenyl)-4-(3-methyl-5-phenyl-pyrazol-1-yl)benzamide Openeye Name: N-(4-butoxyphenyl)-4-(3-methyl-5-phenyl-pyrazol-1-yl)benzamide CAS Name: N-(4-butoxyphenyl)-4-(3-methyl-5-phenyl-1-pyrazolyl)benzamide IUPAC Name: N-(4-butoxyphenyl)-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide Traditional Name: N-(4-butoxyphenyl)-4-(3-methyl-5-phenyl-pyrazol-1-yl)benzamide Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=CC(=N3)C)C4=CC=CC=C4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=CC(=N3)C)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O2/c1-3-4-18-32-25-16-12-23(13-17-25)28-27(31)22-10-14-24(15-11-22)30-26(19-20(2)29-30)21-8-6-5-7-9-21/h5-17,19H,3-4,18H2,1-2H3,(H,28,31)