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

Systemtic Name: 5-butyl-1-(cyclohexylmethyl)-2-methyl-4-(4-pyrrolidin-1-ylphenyl)pyrrole-3-carboxamide Openeye Name: 5-butyl-1-(cyclohexylmethyl)-2-methyl-4-(4-pyrrolidin-1-ylphenyl)pyrrole-3-carboxamide CAS Name: 5-butyl-1-(cyclohexylmethyl)-2-methyl-4-[4-(1-pyrrolidinyl)phenyl]-3-pyrrolecarboxamide IUPAC Name: 5-butyl-1-(cyclohexylmethyl)-2-methyl-4-(4-pyrrolidin-1-ylphenyl)pyrrole-3-carboxamide Traditional Name: 5-butyl-1-(cyclohexylmethyl)-2-methyl-4-(4-pyrrolidinophenyl)pyrrole-3-carboxamide Formula: C27H39N3O MolecularWeight: 421.61806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CC2CCCCC2)C)C(=O)N)C3=CC=C(C=C3)N4CCCC4

Isomeric SMILES

CCCCC1=C(C(=C(N1CC2CCCCC2)C)C(=O)N)C3=CC=C(C=C3)N4CCCC4

InChI

InChI=1S/C27H39N3O/c1-3-4-12-24-26(22-13-15-23(16-14-22)29-17-8-9-18-29)25(27(28)31)20(2)30(24)19-21-10-6-5-7-11-21/h13-16,21H,3-12,17-19H2,1-2H3,(H2,28,31)