N-[2-(3-azanyl-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2-(4-bromanylphenoxy)-2-methyl-propanamide

Systemtic Name: N-[2-(3-azanyl-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2-(4-bromanylphenoxy)-2-methyl-propanamide Openeye Name: N-[2-(3-amino-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2-(4-bromophenoxy)-2-methyl-propanamide CAS Name: N-[2-(3-amino-4-methylphenyl)-1,3-benzoxazol-5-yl]-2-(4-bromophenoxy)-2-methylpropanamide IUPAC Name: N-[2-(3-amino-4-methylphenyl)-1,3-benzoxazol-5-yl]-2-(4-bromophenoxy)-2-methylpropanamide Traditional Name: N-[2-(3-amino-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-2-(4-bromophenoxy)-2-methyl-propionamide Formula: C24H22BrN3O3 MolecularWeight: 480.35378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C(C)(C)OC4=CC=C(C=C4)Br)N

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C(C)(C)OC4=CC=C(C=C4)Br)N

InChI

InChI=1S/C24H22BrN3O3/c1-14-4-5-15(12-19(14)26)22-28-20-13-17(8-11-21(20)30-22)27-23(29)24(2,3)31-18-9-6-16(25)7-10-18/h4-13H,26H2,1-3H3,(H,27,29)