N-[(2S)-butan-2-yl]-2-[(6-tert-butyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]-1,3-oxazole-4-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-2-[(6-tert-butyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-[(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-N-[(1S)-1-methylpropyl]oxazole-4-carboxamide CAS Name: N-[(2S)-butan-2-yl]-2-[(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-4-oxazolecarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-2-[(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-1,3-oxazole-4-carboxamide Traditional Name: 2-[(6-tert-butyl-3-keto-1,4-benzoxazin-4-yl)methyl]-N-[(1S)-1-methylpropyl]oxazole-4-carboxamide Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=COC(=N1)CN2C(=O)COC3=C2C=C(C=C3)C(C)(C)C

Isomeric SMILES

CC[C@H](C)NC(=O)C1=COC(=N1)CN2C(=O)COC3=C2C=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H27N3O4/c1-6-13(2)22-20(26)15-11-28-18(23-15)10-24-16-9-14(21(3,4)5)7-8-17(16)27-12-19(24)25/h7-9,11,13H,6,10,12H2,1-5H3,(H,22,26)/t13-/m0/s1