N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)-2-[(E)-4-phenylbut-3-en-2-yl]thiophene-3-sulfonamide

Systemtic Name: N-(4-bromanyl-3-methyl-1,2-oxazol-5-yl)-2-[(E)-4-phenylbut-3-en-2-yl]thiophene-3-sulfonamide Openeye Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-2-[(E)-1-methyl-3-phenyl-allyl]thiophene-3-sulfonamide CAS Name: N-(4-bromo-3-methyl-5-isoxazolyl)-2-[(E)-4-phenylbut-3-en-2-yl]-3-thiophenesulfonamide IUPAC Name: N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-2-[(E)-4-phenylbut-3-en-2-yl]thiophene-3-sulfonamide Traditional Name: N-(4-bromo-3-methyl-isoxazol-5-yl)-2-[(E)-1-methyl-3-phenyl-allyl]thiophene-3-sulfonamide Formula: C18H17BrN2O3S2 MolecularWeight: 453.37318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1Br)NS(=O)(=O)C2=C(SC=C2)C(C)C=CC3=CC=CC=C3

Isomeric SMILES

CC1=NOC(=C1Br)NS(=O)(=O)C2=C(SC=C2)C(C)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C18H17BrN2O3S2/c1-12(8-9-14-6-4-3-5-7-14)17-15(10-11-25-17)26(22,23)21-18-16(19)13(2)20-24-18/h3-12,21H,1-2H3/b9-8+