N-[(3-bromanyl-4-methyl-phenyl)methyl]-N-(2-methoxyethyl)-4-(3-methyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide

Systemtic Name: N-[(3-bromanyl-4-methyl-phenyl)methyl]-N-(2-methoxyethyl)-4-(3-methyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide Openeye Name: N-[(3-bromo-4-methyl-phenyl)methyl]-N-(2-methoxyethyl)-4-(3-methylisoxazol-5-yl)thiophene-2-sulfonamide CAS Name: N-[(3-bromo-4-methylphenyl)methyl]-N-(2-methoxyethyl)-4-(3-methyl-5-isoxazolyl)-2-thiophenesulfonamide IUPAC Name: N-[(3-bromo-4-methylphenyl)methyl]-N-(2-methoxyethyl)-4-(3-methyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide Traditional Name: N-(3-bromo-4-methyl-benzyl)-N-(2-methoxyethyl)-4-(3-methylisoxazol-5-yl)thiophene-2-sulfonamide Formula: C19H21BrN2O4S2 MolecularWeight: 485.41504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CN(CCOC)S(=O)(=O)C2=CC(=CS2)C3=CC(=NO3)C)Br

Isomeric SMILES

CC1=C(C=C(C=C1)CN(CCOC)S(=O)(=O)C2=CC(=CS2)C3=CC(=NO3)C)Br

InChI

InChI=1S/C19H21BrN2O4S2/c1-13-4-5-15(9-17(13)20)11-22(6-7-25-3)28(23,24)19-10-16(12-27-19)18-8-14(2)21-26-18/h4-5,8-10,12H,6-7,11H2,1-3H3