N-(4-tert-butyl-1,3-thiazol-2-yl)-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-(4-tert-butylthiazol-2-yl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-(4-tert-butyl-2-thiazolyl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: N-(4-tert-butylthiazol-2-yl)-2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)acetamide Formula: C17H18N4O5S MolecularWeight: 390.41362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O5S/c1-17(2,3)13-9-27-16(18-13)19-14(22)7-20-11-6-10(21(24)25)4-5-12(11)26-8-15(20)23/h4-6,9H,7-8H2,1-3H3,(H,18,19,22)