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

Systemtic Name: N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)-3-(2-methyl-4-propyl-phenyl)thiophene-2-sulfonamide Openeye Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-3-(2-methyl-4-propyl-phenyl)thiophene-2-sulfonamide CAS Name: N-(4-bromo-3-methyl-5-isoxazolyl)-3-(2-methyl-4-propylphenyl)-2-thiophenesulfonamide IUPAC Name: N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-3-(2-methyl-4-propylphenyl)thiophene-2-sulfonamide Traditional Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-3-(2-methyl-4-propyl-phenyl)thiophene-2-sulfonamide Formula: C18H19BrN2O3S2 MolecularWeight: 455.38906

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)C2=C(SC=C2)S(=O)(=O)NC3=C(C(=NO3)C)Br)C

Isomeric SMILES

CCCC1=CC(=C(C=C1)C2=C(SC=C2)S(=O)(=O)NC3=C(C(=NO3)C)Br)C

InChI

InChI=1S/C18H19BrN2O3S2/c1-4-5-13-6-7-14(11(2)10-13)15-8-9-25-18(15)26(22,23)21-17-16(19)12(3)20-24-17/h6-10,21H,4-5H2,1-3H3