N-(4-butylphenyl)-3-oxidanylidene-2-phenyl-5-prop-2-enyl-pyrazolo[4,3-c]pyridine-7-carboxamide

Systemtic Name: N-(4-butylphenyl)-3-oxidanylidene-2-phenyl-5-prop-2-enyl-pyrazolo[4,3-c]pyridine-7-carboxamide Openeye Name: 5-allyl-N-(4-butylphenyl)-3-oxo-2-phenyl-pyrazolo[4,3-c]pyridine-7-carboxamide CAS Name: N-(4-butylphenyl)-3-oxo-2-phenyl-5-prop-2-enyl-7-pyrazolo[4,3-c]pyridinecarboxamide IUPAC Name: N-(4-butylphenyl)-3-oxo-2-phenyl-5-prop-2-enylpyrazolo[4,3-c]pyridine-7-carboxamide Traditional Name: 5-allyl-N-(4-butylphenyl)-3-keto-2-phenyl-pyrazolo[4,3-c]pyridine-7-carboxamide Formula: C26H26N4O2 MolecularWeight: 426.51024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=CN(C=C3C2=NN(C3=O)C4=CC=CC=C4)CC=C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=CN(C=C3C2=NN(C3=O)C4=CC=CC=C4)CC=C

InChI

InChI=1S/C26H26N4O2/c1-3-5-9-19-12-14-20(15-13-19)27-25(31)22-17-29(16-4-2)18-23-24(22)28-30(26(23)32)21-10-7-6-8-11-21/h4,6-8,10-15,17-18H,2-3,5,9,16H2,1H3,(H,27,31)