(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: (5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: (5-methyl-2-phenyl-oxazol-4-yl)methyl 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-acetamidophenyl)sulfonyl-methylamino]acetic acid (5-methyl-2-phenyl-4-oxazolyl)methyl ester IUPAC Name: (5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 2-[(4-acetamidophenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]acetic acid (5-methyl-2-phenyl-oxazol-4-yl)methyl ester Formula: C22H23N3O6S MolecularWeight: 457.49952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)COC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)COC(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C22H23N3O6S/c1-15-20(24-22(31-15)17-7-5-4-6-8-17)14-30-21(27)13-25(3)32(28,29)19-11-9-18(10-12-19)23-16(2)26/h4-12H,13-14H2,1-3H3,(H,23,26)