N-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxidanylidene-butanamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxidanylidene-butanamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxo-butanamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxobutanamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-oxobutanamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-4-(2,3-dihydro-1,4-benzothiazin-4-yl)-4-keto-butyramide Formula: C20H21BrN2O3S MolecularWeight: 449.36134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CNC(=O)CCC(=O)N2CCSC3=CC=CC=C32

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CNC(=O)CCC(=O)N2CCSC3=CC=CC=C32

InChI

InChI=1S/C20H21BrN2O3S/c1-26-17-7-6-15(21)12-14(17)13-22-19(24)8-9-20(25)23-10-11-27-18-5-3-2-4-16(18)23/h2-7,12H,8-11,13H2,1H3,(H,22,24)