N-[2-(3,4-dimethoxyphenyl)ethyl]-4-ethanoyl-2,3-dihydro-1,4-benzothiazine-6-sulfonamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-ethanoyl-2,3-dihydro-1,4-benzothiazine-6-sulfonamide Openeye Name: 4-acetyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2,3-dihydro-1,4-benzothiazine-6-sulfonamide CAS Name: 4-acetyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2,3-dihydro-1,4-benzothiazine-6-sulfonamide IUPAC Name: 4-acetyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-2,3-dihydro-1,4-benzothiazine-6-sulfonamide Traditional Name: 4-acetyl-N-homoveratryl-2,3-dihydro-1,4-benzothiazine-6-sulfonamide Formula: C20H24N2O5S2 MolecularWeight: 436.54496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCSC2=C1C=C(C=C2)S(=O)(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(=O)N1CCSC2=C1C=C(C=C2)S(=O)(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H24N2O5S2/c1-14(23)22-10-11-28-20-7-5-16(13-17(20)22)29(24,25)21-9-8-15-4-6-18(26-2)19(12-15)27-3/h4-7,12-13,21H,8-11H2,1-3H3