3-(3-bromophenyl)-N-(4-morpholin-4-ylsulfonylphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: 3-(3-bromophenyl)-N-(4-morpholin-4-ylsulfonylphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: 3-(3-bromophenyl)-N-(4-morpholinosulfonylphenyl)-4,5-dihydroisoxazole-5-carboxamide CAS Name: 3-(3-bromophenyl)-N-[4-(4-morpholinylsulfonyl)phenyl]-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: 3-(3-bromophenyl)-N-(4-morpholin-4-ylsulfonylphenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: 3-(3-bromophenyl)-N-(4-morpholinosulfonylphenyl)-2-isoxazoline-5-carboxamide Formula: C20H20BrN3O5S MolecularWeight: 494.3589

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CC(=NO3)C4=CC(=CC=C4)Br

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CC(=NO3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C20H20BrN3O5S/c21-15-3-1-2-14(12-15)18-13-19(29-23-18)20(25)22-16-4-6-17(7-5-16)30(26,27)24-8-10-28-11-9-24/h1-7,12,19H,8-11,13H2,(H,22,25)