N-[1-(4-butan-2-ylphenyl)propyl]-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[1-(4-butan-2-ylphenyl)propyl]-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: 1-[(2-methylphenoxy)methyl]-N-[1-(4-sec-butylphenyl)propyl]pyrazole-3-carboxamide CAS Name: N-[1-(4-butan-2-ylphenyl)propyl]-1-[(2-methylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[1-(4-butan-2-ylphenyl)propyl]-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: 1-[(2-methylphenoxy)methyl]-N-[1-(4-sec-butylphenyl)propyl]pyrazole-3-carboxamide Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3C

InChI

InChI=1S/C25H31N3O2/c1-5-18(3)20-11-13-21(14-12-20)22(6-2)26-25(29)23-15-16-28(27-23)17-30-24-10-8-7-9-19(24)4/h7-16,18,22H,5-6,17H2,1-4H3,(H,26,29)