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

Systemtic Name: 5-butyl-1-(cyclohexylmethyl)-4-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-methyl-pyrrole-3-carboxamide Openeye Name: 5-butyl-1-(cyclohexylmethyl)-4-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-methyl-pyrrole-3-carboxamide CAS Name: 5-butyl-1-(cyclohexylmethyl)-4-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-methyl-3-pyrrolecarboxamide IUPAC Name: 5-butyl-1-(cyclohexylmethyl)-4-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-methylpyrrole-3-carboxamide Traditional Name: 5-butyl-1-(cyclohexylmethyl)-4-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-methyl-pyrrole-3-carboxamide Formula: C28H38N4O2 MolecularWeight: 462.62692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CC2CCCCC2)C)C(=O)N)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CCCCC1=C(C(=C(N1CC2CCCCC2)C)C(=O)N)C3=C(N(N(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C28H38N4O2/c1-5-6-17-23-26(24(27(29)33)20(3)31(23)18-21-13-9-7-10-14-21)25-19(2)30(4)32(28(25)34)22-15-11-8-12-16-22/h8,11-12,15-16,21H,5-7,9-10,13-14,17-18H2,1-4H3,(H2,29,33)