3-(4-methoxyphenyl)-N-[(2S)-pentan-2-yl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(4-methoxyphenyl)-N-[(2S)-pentan-2-yl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(4-methoxyphenyl)-N-[(1S)-1-methylbutyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(4-methoxyphenyl)-N-[(2S)-pentan-2-yl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(4-methoxyphenyl)-N-[(2S)-pentan-2-yl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(4-methoxyphenyl)-N-[(1S)-1-methylbutyl]-1-phenyl-pyrazole-4-carboxamide Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C1=CN(N=C1C2=CC=C(C=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CCC[C@H](C)NC(=O)C1=CN(N=C1C2=CC=C(C=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H25N3O2/c1-4-8-16(2)23-22(26)20-15-25(18-9-6-5-7-10-18)24-21(20)17-11-13-19(27-3)14-12-17/h5-7,9-16H,4,8H2,1-3H3,(H,23,26)/t16-/m0/s1