N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)-2-[(4-methoxyphenyl)methyl]-1-benzothiophene-3-sulfonamide

Systemtic Name: N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)-2-[(4-methoxyphenyl)methyl]-1-benzothiophene-3-sulfonamide Openeye Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-2-[(4-methoxyphenyl)methyl]benzothiophene-3-sulfonamide CAS Name: N-(4-bromo-3-methyl-5-isoxazolyl)-2-[(4-methoxyphenyl)methyl]-1-benzothiophene-3-sulfonamide IUPAC Name: N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-[(4-methoxyphenyl)methyl]-1-benzothiophene-3-sulfonamide Traditional Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-2-p-anisyl-benzothiophene-3-sulfonamide Formula: C20H17BrN2O4S2 MolecularWeight: 493.39398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1Br)NS(=O)(=O)C2=C(SC3=CC=CC=C32)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NOC(=C1Br)NS(=O)(=O)C2=C(SC3=CC=CC=C32)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C20H17BrN2O4S2/c1-12-18(21)20(27-22-12)23-29(24,25)19-15-5-3-4-6-16(15)28-17(19)11-13-7-9-14(26-2)10-8-13/h3-10,23H,11H2,1-2H3