methyl 4-[[2-ethylimino-4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-1,3-thiazol-3-yl]iminomethyl]benzoate

Systemtic Name: methyl 4-[[2-ethylimino-4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-1,3-thiazol-3-yl]iminomethyl]benzoate Openeye Name: methyl 4-[[2-ethylimino-4-(3-oxo-4H-1,4-benzoxazin-6-yl)thiazol-3-yl]iminomethyl]benzoate CAS Name: 4-[[2-ethylimino-4-(3-oxo-4H-1,4-benzoxazin-6-yl)-3-thiazolyl]iminomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-ethylimino-4-(3-oxo-4H-1,4-benzoxazin-6-yl)-1,3-thiazol-3-yl]iminomethyl]benzoate Traditional Name: 4-[[2-ethylimino-4-(3-keto-4H-1,4-benzoxazin-6-yl)-4-thiazolin-3-yl]iminomethyl]benzoic acid methyl ester Formula: C22H20N4O4S MolecularWeight: 436.4836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=CC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CCN=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=CC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C22H20N4O4S/c1-3-23-22-26(24-11-14-4-6-15(7-5-14)21(28)29-2)18(13-31-22)16-8-9-19-17(10-16)25-20(27)12-30-19/h4-11,13H,3,12H2,1-2H3,(H,25,27)