N-[1-[(2-cyclopropyl-1,3-benzoxazol-5-yl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[1-[(2-cyclopropyl-1,3-benzoxazol-5-yl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzamide Openeye Name: N-[1-[(2-cyclopropyl-1,3-benzoxazol-5-yl)carbamoyl]-2-methyl-propyl]-4-fluoro-benzamide CAS Name: N-[1-[(2-cyclopropyl-1,3-benzoxazol-5-yl)amino]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide IUPAC Name: N-[1-[(2-cyclopropyl-1,3-benzoxazol-5-yl)amino]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide Traditional Name: N-[1-[(2-cyclopropyl-1,3-benzoxazol-5-yl)carbamoyl]-2-methyl-propyl]-4-fluoro-benzamide Formula: C22H22FN3O3 MolecularWeight: 395.426783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC2=C(C=C1)OC(=N2)C3CC3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)C(C(=O)NC1=CC2=C(C=C1)OC(=N2)C3CC3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H22FN3O3/c1-12(2)19(26-20(27)13-5-7-15(23)8-6-13)21(28)24-16-9-10-18-17(11-16)25-22(29-18)14-3-4-14/h5-12,14,19H,3-4H2,1-2H3,(H,24,28)(H,26,27)