2-(4-chlorophenyl)-N-hexyl-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-N-hexyl-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide Openeye Name: 2-(4-chlorophenyl)-N-hexyl-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide CAS Name: 2-(4-chlorophenyl)-N-hexyl-5-(1-methyl-2-pyrrolyl)-3-pyrazolecarboxamide IUPAC Name: 2-(4-chlorophenyl)-N-hexyl-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide Traditional Name: 2-(4-chlorophenyl)-N-hexyl-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide Formula: C21H25ClN4O MolecularWeight: 384.9024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=CC(=NN1C2=CC=C(C=C2)Cl)C3=CC=CN3C

Isomeric SMILES

CCCCCCNC(=O)C1=CC(=NN1C2=CC=C(C=C2)Cl)C3=CC=CN3C

InChI

InChI=1S/C21H25ClN4O/c1-3-4-5-6-13-23-21(27)20-15-18(19-8-7-14-25(19)2)24-26(20)17-11-9-16(22)10-12-17/h7-12,14-15H,3-6,13H2,1-2H3,(H,23,27)