N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-4-hexyl-benzamide

Systemtic Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-4-hexyl-benzamide Openeye Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-4-hexyl-benzamide CAS Name: N-[5-tert-butyl-2-(4-methoxyphenyl)-3-pyrazolyl]-4-hexylbenzamide IUPAC Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-4-hexylbenzamide Traditional Name: N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]-4-hexyl-benzamide Formula: C27H35N3O2 MolecularWeight: 433.5857

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)NC2=CC(=NN2C3=CC=C(C=C3)OC)C(C)(C)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)NC2=CC(=NN2C3=CC=C(C=C3)OC)C(C)(C)C

InChI

InChI=1S/C27H35N3O2/c1-6-7-8-9-10-20-11-13-21(14-12-20)26(31)28-25-19-24(27(2,3)4)29-30(25)22-15-17-23(32-5)18-16-22/h11-19H,6-10H2,1-5H3,(H,28,31)