2-methyl-N-(4-methylphenyl)sulfonyl-3-[4,4,4-tris(fluoranyl)-3-oxidanylidene-but-1-enyl]indolizine-1-carboxamide

Systemtic Name: 2-methyl-N-(4-methylphenyl)sulfonyl-3-[4,4,4-tris(fluoranyl)-3-oxidanylidene-but-1-enyl]indolizine-1-carboxamide Openeye Name: 2-methyl-N-(p-tolylsulfonyl)-3-(4,4,4-trifluoro-3-oxo-but-1-enyl)indolizine-1-carboxamide CAS Name: 2-methyl-N-(4-methylphenyl)sulfonyl-3-(4,4,4-trifluoro-3-oxobut-1-enyl)-1-indolizinecarboxamide IUPAC Name: 2-methyl-N-(4-methylphenyl)sulfonyl-3-(4,4,4-trifluoro-3-oxobut-1-enyl)indolizine-1-carboxamide Traditional Name: 2-methyl-N-tosyl-3-(4,4,4-trifluoro-3-keto-but-1-enyl)indolizine-1-carboxamide Formula: C21H17F3N2O4S MolecularWeight: 450.43089

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=C3C=CC=CN3C(=C2C)C=CC(=O)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=C3C=CC=CN3C(=C2C)C=CC(=O)C(F)(F)F

InChI

InChI=1S/C21H17F3N2O4S/c1-13-6-8-15(9-7-13)31(29,30)25-20(28)19-14(2)16(10-11-18(27)21(22,23)24)26-12-4-3-5-17(19)26/h3-12H,1-2H3,(H,25,28)