4-butoxy-N-[2-[(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)sulfanyl]ethyl]benzenesulfonamide

Systemtic Name: 4-butoxy-N-[2-[(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)sulfanyl]ethyl]benzenesulfonamide Openeye Name: 4-butoxy-N-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)sulfanyl]ethyl]benzenesulfonamide CAS Name: 4-butoxy-N-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)thio]ethyl]benzenesulfonamide IUPAC Name: 4-butoxy-N-[2-[(3-oxo-4H-1,4-benzothiazin-2-yl)sulfanyl]ethyl]benzenesulfonamide Traditional Name: 4-butoxy-N-[2-[(3-keto-4H-1,4-benzothiazin-2-yl)thio]ethyl]benzenesulfonamide Formula: C20H24N2O4S3 MolecularWeight: 452.61056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)NCCSC2C(=O)NC3=CC=CC=C3S2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)NCCSC2C(=O)NC3=CC=CC=C3S2

InChI

InChI=1S/C20H24N2O4S3/c1-2-3-13-26-15-8-10-16(11-9-15)29(24,25)21-12-14-27-20-19(23)22-17-6-4-5-7-18(17)28-20/h4-11,20-21H,2-3,12-14H2,1H3,(H,22,23)