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

Systemtic Name: methyl 4-[[4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-2-propan-2-ylimino-1,3-thiazol-3-yl]iminomethyl]benzoate Openeye Name: methyl 4-[[2-isopropylimino-4-(3-oxo-4H-1,4-benzoxazin-6-yl)thiazol-3-yl]iminomethyl]benzoate CAS Name: 4-[[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-2-propan-2-ylimino-3-thiazolyl]iminomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-2-propan-2-ylimino-1,3-thiazol-3-yl]iminomethyl]benzoate Traditional Name: 4-[[2-isopropylimino-4-(3-keto-4H-1,4-benzoxazin-6-yl)-4-thiazolin-3-yl]iminomethyl]benzoic acid methyl ester Formula: C23H22N4O4S MolecularWeight: 450.51018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N4O4S/c1-14(2)25-23-27(24-11-15-4-6-16(7-5-15)22(29)30-3)19(13-32-23)17-8-9-20-18(10-17)26-21(28)12-31-20/h4-11,13-14H,12H2,1-3H3,(H,26,28)