N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-[4-(2,4-dimethylphenyl)thiazol-2-yl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-[4-(2,4-dimethylphenyl)-2-thiazolyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: N-[4-(2,4-dimethylphenyl)thiazol-2-yl]-2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)acetamide Formula: C21H18N4O5S MolecularWeight: 438.45642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CN3C(=O)COC4=C3C=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CN3C(=O)COC4=C3C=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C21H18N4O5S/c1-12-3-5-15(13(2)7-12)16-11-31-21(22-16)23-19(26)9-24-17-8-14(25(28)29)4-6-18(17)30-10-20(24)27/h3-8,11H,9-10H2,1-2H3,(H,22,23,26)