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

Systemtic Name: ethyl 4-[[3-cyclopentyl-4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[3-cyclopentyl-4-(3-oxo-4H-1,4-benzoxazin-6-yl)thiazol-2-ylidene]amino]benzoate CAS Name: 4-[[3-cyclopentyl-4-(3-oxo-4H-1,4-benzoxazin-6-yl)-2-thiazolylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-cyclopentyl-4-(3-oxo-4H-1,4-benzoxazin-6-yl)-1,3-thiazol-2-ylidene]amino]benzoate Traditional Name: 4-[[3-cyclopentyl-4-(3-keto-4H-1,4-benzoxazin-6-yl)-4-thiazolin-2-ylidene]amino]benzoic acid ethyl ester Formula: C25H25N3O4S MolecularWeight: 463.5487

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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)C5CCCC5

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)C5CCCC5

InChI

InChI=1S/C25H25N3O4S/c1-2-31-24(30)16-7-10-18(11-8-16)26-25-28(19-5-3-4-6-19)21(15-33-25)17-9-12-22-20(13-17)27-23(29)14-32-22/h7-13,15,19H,2-6,14H2,1H3,(H,27,29)