ethyl 4-[[3-cyclopropyl-4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-ylidene]amino]benzoate

Systemtic Name: ethyl 4-[[3-cyclopropyl-4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[3-cyclopropyl-4-(3-oxo-4H-1,4-benzoxazin-6-yl)thiazol-2-ylidene]amino]benzoate CAS Name: 4-[[3-cyclopropyl-4-(3-oxo-4H-1,4-benzoxazin-6-yl)-2-thiazolylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-cyclopropyl-4-(3-oxo-4H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-ylidene]amino]benzoate Traditional Name: 4-[[3-cyclopropyl-4-(3-keto-4H-1,4-benzoxazin-6-yl)-4-thiazolin-2-ylidene]amino]benzoic acid ethyl ester Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)C5CC5

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)C5CC5

InChI

InChI=1S/C23H21N3O4S/c1-2-29-22(28)14-3-6-16(7-4-14)24-23-26(17-8-9-17)19(13-31-23)15-5-10-20-18(11-15)25-21(27)12-30-20/h3-7,10-11,13,17H,2,8-9,12H2,1H3,(H,25,27)