N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)propanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)propanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-oxo-4H-1,4-benzothiazin-2-yl)propanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-oxo-4H-1,4-benzothiazin-2-yl)propanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-oxo-4H-1,4-benzothiazin-2-yl)propanamide Traditional Name: N-homoveratryl-2-(3-keto-4H-1,4-benzothiazin-2-yl)propionamide Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C(=O)NC2=CC=CC=C2S1)C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C1C(=O)NC2=CC=CC=C2S1)C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H24N2O4S/c1-13(19-21(25)23-15-6-4-5-7-18(15)28-19)20(24)22-11-10-14-8-9-16(26-2)17(12-14)27-3/h4-9,12-13,19H,10-11H2,1-3H3,(H,22,24)(H,23,25)