5-butyl-1-[2-(4-hydroxyphenyl)ethyl]-2-methyl-4-(1,3-thiazol-2-yl)pyrrole-3-carboxamide

Systemtic Name: 5-butyl-1-[2-(4-hydroxyphenyl)ethyl]-2-methyl-4-(1,3-thiazol-2-yl)pyrrole-3-carboxamide Openeye Name: 5-butyl-1-[2-(4-hydroxyphenyl)ethyl]-2-methyl-4-thiazol-2-yl-pyrrole-3-carboxamide CAS Name: 5-butyl-1-[2-(4-hydroxyphenyl)ethyl]-2-methyl-4-(2-thiazolyl)-3-pyrrolecarboxamide IUPAC Name: 5-butyl-1-[2-(4-hydroxyphenyl)ethyl]-2-methyl-4-(1,3-thiazol-2-yl)pyrrole-3-carboxamide Traditional Name: 5-butyl-1-[2-(4-hydroxyphenyl)ethyl]-2-methyl-4-thiazol-2-yl-pyrrole-3-carboxamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCC2=CC=C(C=C2)O)C)C(=O)N)C3=NC=CS3

Isomeric SMILES

CCCCC1=C(C(=C(N1CCC2=CC=C(C=C2)O)C)C(=O)N)C3=NC=CS3

InChI

InChI=1S/C21H25N3O2S/c1-3-4-5-17-19(21-23-11-13-27-21)18(20(22)26)14(2)24(17)12-10-15-6-8-16(25)9-7-15/h6-9,11,13,25H,3-5,10,12H2,1-2H3,(H2,22,26)