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

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-(4-chloranyl-3-methyl-1,2-oxazol-5-yl)-5-(2-methylpropylamino)-1-benzothiophene-3-sulfonamide Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-(4-chloro-3-methyl-isoxazol-5-yl)-5-(isobutylamino)benzothiophene-3-sulfonamide CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-(4-chloro-3-methyl-5-isoxazolyl)-5-(2-methylpropylamino)-1-benzothiophene-3-sulfonamide IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-5-(2-methylpropylamino)-1-benzothiophene-3-sulfonamide Traditional Name: N-(4-chloro-3-methyl-isoxazol-5-yl)-5-(isobutylamino)-2-piperonyl-benzothiophene-3-sulfonamide Formula: C24H24ClN3O5S2 MolecularWeight: 534.04746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1Cl)NS(=O)(=O)C2=C(SC3=C2C=C(C=C3)NCC(C)C)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=NOC(=C1Cl)NS(=O)(=O)C2=C(SC3=C2C=C(C=C3)NCC(C)C)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H24ClN3O5S2/c1-13(2)11-26-16-5-7-20-17(10-16)23(35(29,30)28-24-22(25)14(3)27-33-24)21(34-20)9-15-4-6-18-19(8-15)32-12-31-18/h4-8,10,13,26,28H,9,11-12H2,1-3H3