N-[1-(4-butan-2-ylphenyl)propyl]-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-[1-(4-butan-2-ylphenyl)propyl]-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: 1,3-diphenyl-N-[1-(4-sec-butylphenyl)propyl]pyrazole-4-carboxamide CAS Name: N-[1-(4-butan-2-ylphenyl)propyl]-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[1-(4-butan-2-ylphenyl)propyl]-1,3-diphenylpyrazole-4-carboxamide Traditional Name: 1,3-diphenyl-N-[1-(4-sec-butylphenyl)propyl]pyrazole-4-carboxamide Formula: C29H31N3O MolecularWeight: 437.57594

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H31N3O/c1-4-21(3)22-16-18-23(19-17-22)27(5-2)30-29(33)26-20-32(25-14-10-7-11-15-25)31-28(26)24-12-8-6-9-13-24/h6-21,27H,4-5H2,1-3H3,(H,30,33)