N-(2-tert-butyl-1,3-benzoxazol-5-yl)-3-(4-methylphenyl)sulfonyl-propanamide

Systemtic Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-3-(p-tolylsulfonyl)propanamide CAS Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-(2-tert-butyl-1,3-benzoxazol-5-yl)-3-tosyl-propionamide Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=CC3=C(C=C2)OC(=N3)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC2=CC3=C(C=C2)OC(=N3)C(C)(C)C

InChI

InChI=1S/C21H24N2O4S/c1-14-5-8-16(9-6-14)28(25,26)12-11-19(24)22-15-7-10-18-17(13-15)23-20(27-18)21(2,3)4/h5-10,13H,11-12H2,1-4H3,(H,22,24)