N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-2-[(2-methyl-5-prop-2-enylsulfonyl-phenyl)amino]ethanamide

Systemtic Name: N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-2-[(2-methyl-5-prop-2-enylsulfonyl-phenyl)amino]ethanamide Openeye Name: 2-(5-allylsulfonyl-2-methyl-anilino)-N-[2-(2,3-dimethylanilino)-2-oxo-ethyl]acetamide CAS Name: N-[2-(2,3-dimethylanilino)-2-oxoethyl]-2-(2-methyl-5-prop-2-enylsulfonylanilino)acetamide IUPAC Name: N-[2-(2,3-dimethylanilino)-2-oxoethyl]-2-(2-methyl-5-prop-2-enylsulfonylanilino)acetamide Traditional Name: 2-(5-allylsulfonyl-2-methyl-anilino)-N-[2-(2,3-dimethylanilino)-2-keto-ethyl]acetamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CNC(=O)CNC2=C(C=CC(=C2)S(=O)(=O)CC=C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CNC(=O)CNC2=C(C=CC(=C2)S(=O)(=O)CC=C)C)C

InChI

InChI=1S/C22H27N3O4S/c1-5-11-30(28,29)18-10-9-16(3)20(12-18)23-13-21(26)24-14-22(27)25-19-8-6-7-15(2)17(19)4/h5-10,12,23H,1,11,13-14H2,2-4H3,(H,24,26)(H,25,27)