(E)-2-(1H-imidazol-5-yl)-N,N-dimethyl-3-(4-methylphenyl)sulfonyl-but-2-enamide

Systemtic Name: (E)-2-(1H-imidazol-5-yl)-N,N-dimethyl-3-(4-methylphenyl)sulfonyl-but-2-enamide Openeye Name: (E)-2-(1H-imidazol-5-yl)-N,N-dimethyl-3-(p-tolylsulfonyl)but-2-enamide CAS Name: (E)-2-(1H-imidazol-5-yl)-N,N-dimethyl-3-(4-methylphenyl)sulfonyl-2-butenamide IUPAC Name: (E)-2-(1H-imidazol-5-yl)-N,N-dimethyl-3-(4-methylphenyl)sulfonylbut-2-enamide Traditional Name: (E)-2-(1H-imidazol-5-yl)-N,N-dimethyl-3-tosyl-but-2-enamide Formula: C16H19N3O3S MolecularWeight: 333.40536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=C(C2=CN=CN2)C(=O)N(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C(\C2=CN=CN2)/C(=O)N(C)C)/C

InChI

InChI=1S/C16H19N3O3S/c1-11-5-7-13(8-6-11)23(21,22)12(2)15(16(20)19(3)4)14-9-17-10-18-14/h5-10H,1-4H3,(H,17,18)/b15-12+