N-(3-methylbutyl)-2-(3-methylphenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide

Systemtic Name: N-(3-methylbutyl)-2-(3-methylphenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide Openeye Name: N-isopentyl-5-(1-methylpyrrol-2-yl)-2-(m-tolyl)pyrazole-3-carboxamide CAS Name: N-(3-methylbutyl)-2-(3-methylphenyl)-5-(1-methyl-2-pyrrolyl)-3-pyrazolecarboxamide IUPAC Name: N-(3-methylbutyl)-2-(3-methylphenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide Traditional Name: N-isoamyl-5-(1-methylpyrrol-2-yl)-2-(m-tolyl)pyrazole-3-carboxamide Formula: C21H26N4O MolecularWeight: 350.45734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=N2)C3=CC=CN3C)C(=O)NCCC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=N2)C3=CC=CN3C)C(=O)NCCC(C)C

InChI

InChI=1S/C21H26N4O/c1-15(2)10-11-22-21(26)20-14-18(19-9-6-12-24(19)4)23-25(20)17-8-5-7-16(3)13-17/h5-9,12-15H,10-11H2,1-4H3,(H,22,26)