5-butyl-1-(cyclohexylmethyl)-2-methyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide

Systemtic Name: 5-butyl-1-(cyclohexylmethyl)-2-methyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide Openeye Name: 5-butyl-1-(cyclohexylmethyl)-2-methyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide CAS Name: 5-butyl-1-(cyclohexylmethyl)-2-methyl-4-(3-phenoxyphenyl)-3-pyrrolecarboxamide IUPAC Name: 5-butyl-1-(cyclohexylmethyl)-2-methyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide Traditional Name: 5-butyl-1-(cyclohexylmethyl)-2-methyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide Formula: C29H36N2O2 MolecularWeight: 444.60834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CC2CCCCC2)C)C(=O)N)C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CCCCC1=C(C(=C(N1CC2CCCCC2)C)C(=O)N)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C29H36N2O2/c1-3-4-18-26-28(23-14-11-17-25(19-23)33-24-15-9-6-10-16-24)27(29(30)32)21(2)31(26)20-22-12-7-5-8-13-22/h6,9-11,14-17,19,22H,3-5,7-8,12-13,18,20H2,1-2H3,(H2,30,32)