4-cyano-2-methyl-N-(2-phenylbutyl)-5-pyrrol-1-yl-furan-3-carboxamide

Systemtic Name: 4-cyano-2-methyl-N-(2-phenylbutyl)-5-pyrrol-1-yl-furan-3-carboxamide Openeye Name: 4-cyano-2-methyl-N-(2-phenylbutyl)-5-pyrrol-1-yl-furan-3-carboxamide CAS Name: 4-cyano-2-methyl-N-(2-phenylbutyl)-5-(1-pyrrolyl)-3-furancarboxamide IUPAC Name: 4-cyano-2-methyl-N-(2-phenylbutyl)-5-pyrrol-1-ylfuran-3-carboxamide Traditional Name: 4-cyano-2-methyl-N-(2-phenylbutyl)-5-pyrrol-1-yl-3-furamide Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1=C(OC(=C1C#N)N2C=CC=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCC(CNC(=O)C1=C(OC(=C1C#N)N2C=CC=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2/c1-3-16(17-9-5-4-6-10-17)14-23-20(25)19-15(2)26-21(18(19)13-22)24-11-7-8-12-24/h4-12,16H,3,14H2,1-2H3,(H,23,25)