N-(4-bromanyl-2-methyl-phenyl)-2-[[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxidanylidene-ethyl]-methyl-amino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxidanylidene-ethyl]-methyl-amino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxo-ethyl]-methyl-amino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxoethyl]-methylamino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxoethyl]-methylamino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-keto-ethyl]-methyl-amino]acetamide Formula: C20H22BrN3O2S MolecularWeight: 448.37658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)CC(=O)N2CCSC3=CC=CC=C32

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)CC(=O)N2CCSC3=CC=CC=C32

InChI

InChI=1S/C20H22BrN3O2S/c1-14-11-15(21)7-8-16(14)22-19(25)12-23(2)13-20(26)24-9-10-27-18-6-4-3-5-17(18)24/h3-8,11H,9-10,12-13H2,1-2H3,(H,22,25)