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

Systemtic Name: 4-cyano-2-methyl-N-(5-methylhexan-2-yl)-5-pyrrol-1-yl-furan-3-carboxamide Openeye Name: 4-cyano-N-(1,4-dimethylpentyl)-2-methyl-5-pyrrol-1-yl-furan-3-carboxamide CAS Name: 4-cyano-2-methyl-N-(5-methylhexan-2-yl)-5-(1-pyrrolyl)-3-furancarboxamide IUPAC Name: 4-cyano-2-methyl-N-(5-methylhexan-2-yl)-5-pyrrol-1-ylfuran-3-carboxamide Traditional Name: 4-cyano-N-(1,4-dimethylpentyl)-2-methyl-5-pyrrol-1-yl-3-furamide Formula: C18H23N3O2 MolecularWeight: 313.39412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)NC(C)CCC(C)C

Isomeric SMILES

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)NC(C)CCC(C)C

InChI

InChI=1S/C18H23N3O2/c1-12(2)7-8-13(3)20-17(22)16-14(4)23-18(15(16)11-19)21-9-5-6-10-21/h5-6,9-10,12-13H,7-8H2,1-4H3,(H,20,22)