N-(4-bromanyl-3-methyl-2H-1,2-oxazol-3-yl)-3-phenylsulfanyl-thiophene-2-sulfonamide

Systemtic Name: N-(4-bromanyl-3-methyl-2H-1,2-oxazol-3-yl)-3-phenylsulfanyl-thiophene-2-sulfonamide Openeye Name: N-(4-bromo-3-methyl-2H-isoxazol-3-yl)-3-phenylsulfanyl-thiophene-2-sulfonamide CAS Name: N-(4-bromo-3-methyl-2H-isoxazol-3-yl)-3-(phenylthio)-2-thiophenesulfonamide IUPAC Name: N-(4-bromo-3-methyl-2H-1,2-oxazol-3-yl)-3-phenylsulfanylthiophene-2-sulfonamide Traditional Name: N-(4-bromo-3-methyl-4-isoxazolin-3-yl)-3-(phenylthio)thiophene-2-sulfonamide Formula: C14H13BrN2O3S3 MolecularWeight: 433.36362

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=CON1)Br)NS(=O)(=O)C2=C(C=CS2)SC3=CC=CC=C3

Isomeric SMILES

CC1(C(=CON1)Br)NS(=O)(=O)C2=C(C=CS2)SC3=CC=CC=C3

InChI

InChI=1S/C14H13BrN2O3S3/c1-14(12(15)9-20-16-14)17-23(18,19)13-11(7-8-21-13)22-10-5-3-2-4-6-10/h2-9,16-17H,1H3