N-[(E)-3,3-dimethylbutan-2-ylideneamino]-2-[methylsulfonyl-(4-phenoxyphenyl)amino]ethanamide

Systemtic Name: N-[(E)-3,3-dimethylbutan-2-ylideneamino]-2-[methylsulfonyl-(4-phenoxyphenyl)amino]ethanamide Openeye Name: 2-(N-methylsulfonyl-4-phenoxy-anilino)-N-[(E)-1,2,2-trimethylpropylideneamino]acetamide CAS Name: N-[(E)-3,3-dimethylbutan-2-ylideneamino]-2-(N-methylsulfonyl-4-phenoxyanilino)acetamide IUPAC Name: N-[(E)-3,3-dimethylbutan-2-ylideneamino]-2-(N-methylsulfonyl-4-phenoxyanilino)acetamide Traditional Name: 2-(N-mesyl-4-phenoxy-anilino)-N-[(E)-1,2,2-trimethylpropylideneamino]acetamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CN(C1=CC=C(C=C1)OC2=CC=CC=C2)S(=O)(=O)C)C(C)(C)C

Isomeric SMILES

C/C(=N\NC(=O)CN(C1=CC=C(C=C1)OC2=CC=CC=C2)S(=O)(=O)C)/C(C)(C)C

InChI

InChI=1S/C21H27N3O4S/c1-16(21(2,3)4)22-23-20(25)15-24(29(5,26)27)17-11-13-19(14-12-17)28-18-9-7-6-8-10-18/h6-14H,15H2,1-5H3,(H,23,25)/b22-16+