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

Systemtic Name: N-[3-(1,3-benzoxazol-2-yl)-5-(2-methylpropanoylamino)phenyl]-2-methyl-propanamide Openeye Name: N-[3-(1,3-benzoxazol-2-yl)-5-(2-methylpropanoylamino)phenyl]-2-methyl-propanamide CAS Name: N-[3-(1,3-benzoxazol-2-yl)-5-[(2-methyl-1-oxopropyl)amino]phenyl]-2-methylpropanamide IUPAC Name: N-[3-(1,3-benzoxazol-2-yl)-5-(2-methylpropanoylamino)phenyl]-2-methylpropanamide Traditional Name: N-[3-(1,3-benzoxazol-2-yl)-5-(isobutyrylamino)phenyl]-2-methyl-propionamide Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=CC(=C1)C2=NC3=CC=CC=C3O2)NC(=O)C(C)C

Isomeric SMILES

CC(C)C(=O)NC1=CC(=CC(=C1)C2=NC3=CC=CC=C3O2)NC(=O)C(C)C

InChI

InChI=1S/C21H23N3O3/c1-12(2)19(25)22-15-9-14(10-16(11-15)23-20(26)13(3)4)21-24-17-7-5-6-8-18(17)27-21/h5-13H,1-4H3,(H,22,25)(H,23,26)