N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanamide

Systemtic Name: N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanamide Openeye Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide CAS Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide IUPAC Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetamide Traditional Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(3-keto-4H-1,4-benzothiazin-2-yl)acetamide Formula: C20H19ClN2O4S MolecularWeight: 418.89386

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CNC(=O)CC3C(=O)NC4=CC=CC=C4S3)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CNC(=O)CC3C(=O)NC4=CC=CC=C4S3)Cl)OC1

InChI

InChI=1S/C20H19ClN2O4S/c21-13-8-12(9-15-19(13)27-7-3-6-26-15)11-22-18(24)10-17-20(25)23-14-4-1-2-5-16(14)28-17/h1-2,4-5,8-9,17H,3,6-7,10-11H2,(H,22,24)(H,23,25)