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

Systemtic Name: N-hexadecyl-4-(3-methyl-5-phenyl-pyrazol-1-yl)benzamide Openeye Name: N-hexadecyl-4-(3-methyl-5-phenyl-pyrazol-1-yl)benzamide CAS Name: N-hexadecyl-4-(3-methyl-5-phenyl-1-pyrazolyl)benzamide IUPAC Name: N-hexadecyl-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide Traditional Name: N-cetyl-4-(3-methyl-5-phenyl-pyrazol-1-yl)benzamide Formula: C33H47N3O MolecularWeight: 501.74578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=O)C1=CC=C(C=C1)N2C(=CC(=N2)C)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=O)C1=CC=C(C=C1)N2C(=CC(=N2)C)C3=CC=CC=C3

InChI

InChI=1S/C33H47N3O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-26-34-33(37)30-22-24-31(25-23-30)36-32(27-28(2)35-36)29-20-17-16-18-21-29/h16-18,20-25,27H,3-15,19,26H2,1-2H3,(H,34,37)