3-azanyl-4-[2-[(4-chlorophenyl)methylsulfonyl]-1-phenyl-ethyl]-4H-1,2-oxazol-5-one

Systemtic Name: 3-azanyl-4-[2-[(4-chlorophenyl)methylsulfonyl]-1-phenyl-ethyl]-4H-1,2-oxazol-5-one Openeye Name: 3-amino-4-[2-[(4-chlorophenyl)methylsulfonyl]-1-phenyl-ethyl]-4H-isoxazol-5-one CAS Name: 3-amino-4-[2-[(4-chlorophenyl)methylsulfonyl]-1-phenylethyl]-4H-isoxazol-5-one IUPAC Name: 3-amino-4-[2-[(4-chlorophenyl)methylsulfonyl]-1-phenylethyl]-4H-1,2-oxazol-5-one Traditional Name: 3-amino-4-[2-(4-chlorobenzyl)sulfonyl-1-phenyl-ethyl]-2-isoxazolin-5-one Formula: C18H17ClN2O4S MolecularWeight: 392.85658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CS(=O)(=O)CC2=CC=C(C=C2)Cl)C3C(=NOC3=O)N

Isomeric SMILES

C1=CC=C(C=C1)C(CS(=O)(=O)CC2=CC=C(C=C2)Cl)C3C(=NOC3=O)N

InChI

InChI=1S/C18H17ClN2O4S/c19-14-8-6-12(7-9-14)10-26(23,24)11-15(13-4-2-1-3-5-13)16-17(20)21-25-18(16)22/h1-9,15-16H,10-11H2,(H2,20,21)