N-(2-bromanyl-4-methyl-phenyl)-3-(2-oxidanylidene-6-sulfamoyl-1,3-benzoxazol-3-yl)propanamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-3-(2-oxidanylidene-6-sulfamoyl-1,3-benzoxazol-3-yl)propanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-3-(2-oxo-6-sulfamoyl-1,3-benzoxazol-3-yl)propanamide CAS Name: N-(2-bromo-4-methylphenyl)-3-(2-oxo-6-sulfamoyl-1,3-benzoxazol-3-yl)propanamide IUPAC Name: N-(2-bromo-4-methylphenyl)-3-(2-oxo-6-sulfamoyl-1,3-benzoxazol-3-yl)propanamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-3-(2-keto-6-sulfamoyl-1,3-benzoxazol-3-yl)propionamide Formula: C17H16BrN3O5S MolecularWeight: 454.29504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCN2C3=C(C=C(C=C3)S(=O)(=O)N)OC2=O)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCN2C3=C(C=C(C=C3)S(=O)(=O)N)OC2=O)Br

InChI

InChI=1S/C17H16BrN3O5S/c1-10-2-4-13(12(18)8-10)20-16(22)6-7-21-14-5-3-11(27(19,24)25)9-15(14)26-17(21)23/h2-5,8-9H,6-7H2,1H3,(H,20,22)(H2,19,24,25)