(4-bromophenyl)-[4-(phenylsulfonyl)-5-thiophen-2-yl-1,2-oxazol-3-yl]methanone

Systemtic Name: (4-bromophenyl)-[4-(phenylsulfonyl)-5-thiophen-2-yl-1,2-oxazol-3-yl]methanone Openeye Name: [4-(benzenesulfonyl)-5-(2-thienyl)isoxazol-3-yl]-(4-bromophenyl)methanone CAS Name: [4-(benzenesulfonyl)-5-thiophen-2-yl-3-isoxazolyl]-(4-bromophenyl)methanone IUPAC Name: [4-(benzenesulfonyl)-5-thiophen-2-yl-1,2-oxazol-3-yl]-(4-bromophenyl)methanone Traditional Name: [4-besyl-5-(2-thienyl)isoxazol-3-yl]-(4-bromophenyl)methanone Formula: C20H12BrNO4S2 MolecularWeight: 474.34758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=C(ON=C2C(=O)C3=CC=C(C=C3)Br)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=C(ON=C2C(=O)C3=CC=C(C=C3)Br)C4=CC=CS4

InChI

InChI=1S/C20H12BrNO4S2/c21-14-10-8-13(9-11-14)18(23)17-20(19(26-22-17)16-7-4-12-27-16)28(24,25)15-5-2-1-3-6-15/h1-12H