2-(1,3-benzodioxol-5-ylmethyl)-N-(4-chloranyl-3-methyl-1,2-oxazol-5-yl)-7-phenoxy-1-benzothiophene-3-sulfonamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-(4-chloranyl-3-methyl-1,2-oxazol-5-yl)-7-phenoxy-1-benzothiophene-3-sulfonamide Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-(4-chloro-3-methyl-isoxazol-5-yl)-7-phenoxy-benzothiophene-3-sulfonamide CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-(4-chloro-3-methyl-5-isoxazolyl)-7-phenoxy-1-benzothiophene-3-sulfonamide IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-7-phenoxy-1-benzothiophene-3-sulfonamide Traditional Name: N-(4-chloro-3-methyl-isoxazol-5-yl)-7-phenoxy-2-piperonyl-benzothiophene-3-sulfonamide Formula: C26H19ClN2O6S2 MolecularWeight: 555.02186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1Cl)NS(=O)(=O)C2=C(SC3=C2C=CC=C3OC4=CC=CC=C4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC1=NOC(=C1Cl)NS(=O)(=O)C2=C(SC3=C2C=CC=C3OC4=CC=CC=C4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C26H19ClN2O6S2/c1-15-23(27)26(35-28-15)29-37(30,31)25-18-8-5-9-20(34-17-6-3-2-4-7-17)24(18)36-22(25)13-16-10-11-19-21(12-16)33-14-32-19/h2-12,29H,13-14H2,1H3