2-[2-fluoranylprop-2-enyl-(4-methylphenyl)sulfonyl-amino]-N-(phenylmethyl)pent-4-enamide

Systemtic Name: 2-[2-fluoranylprop-2-enyl-(4-methylphenyl)sulfonyl-amino]-N-(phenylmethyl)pent-4-enamide Openeye Name: N-benzyl-2-[2-fluoroallyl(p-tolylsulfonyl)amino]pent-4-enamide CAS Name: 2-[2-fluoroprop-2-enyl-(4-methylphenyl)sulfonylamino]-N-(phenylmethyl)-4-pentenamide IUPAC Name: N-benzyl-2-[2-fluoroprop-2-enyl-(4-methylphenyl)sulfonylamino]pent-4-enamide Traditional Name: N-benzyl-2-[2-fluoroallyl(tosyl)amino]pent-4-enamide Formula: C22H25FN2O3S MolecularWeight: 416.508903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=C)F)C(CC=C)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=C)F)C(CC=C)C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C22H25FN2O3S/c1-4-8-21(22(26)24-15-19-9-6-5-7-10-19)25(16-18(3)23)29(27,28)20-13-11-17(2)12-14-20/h4-7,9-14,21H,1,3,8,15-16H2,2H3,(H,24,26)