N-butyl-3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-butyl-3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-butyl-3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: N-butyl-3-(3-methoxyphenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-butyl-3-(3-methoxyphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: N-butyl-3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CN(N=C1C2=CC(=CC=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)C1=CN(N=C1C2=CC(=CC=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O2/c1-3-4-13-22-21(25)19-15-24(17-10-6-5-7-11-17)23-20(19)16-9-8-12-18(14-16)26-2/h5-12,14-15H,3-4,13H2,1-2H3,(H,22,25)