4-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-methyl-1-(3-methylbutyl)-5-pentyl-pyrrole-3-carboxamide

Systemtic Name: 4-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-methyl-1-(3-methylbutyl)-5-pentyl-pyrrole-3-carboxamide Openeye Name: 4-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-1-isopentyl-2-methyl-5-pentyl-pyrrole-3-carboxamide CAS Name: 4-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-methyl-1-(3-methylbutyl)-5-pentyl-3-pyrrolecarboxamide IUPAC Name: 4-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-methyl-1-(3-methylbutyl)-5-pentylpyrrole-3-carboxamide Traditional Name: 5-amyl-1-isoamyl-4-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-methyl-pyrrole-3-carboxamide Formula: C27H38N4O2 MolecularWeight: 450.61622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=C(N(N(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CCCCCC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=C(N(N(C2=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C27H38N4O2/c1-7-8-10-15-22-25(23(26(28)32)20(5)30(22)17-16-18(2)3)24-19(4)29(6)31(27(24)33)21-13-11-9-12-14-21/h9,11-14,18H,7-8,10,15-17H2,1-6H3,(H2,28,32)