6-[2-cyclohexylimino-3-[(5-nitrofuran-2-yl)methylideneamino]-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-cyclohexylimino-3-[(5-nitrofuran-2-yl)methylideneamino]-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-cyclohexylimino-3-[(5-nitro-2-furyl)methyleneamino]thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-cyclohexylimino-3-[(5-nitro-2-furanyl)methylideneamino]-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-cyclohexylimino-3-[(5-nitrofuran-2-yl)methylideneamino]-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-cyclohexylimino-3-[(5-nitro-2-furyl)methyleneamino]-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C22H21N5O5S MolecularWeight: 467.49764

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)N=CC5=CC=C(O5)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)N=CC5=CC=C(O5)[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O5S/c28-20-12-31-19-8-6-14(10-17(19)25-20)18-13-33-22(24-15-4-2-1-3-5-15)26(18)23-11-16-7-9-21(32-16)27(29)30/h6-11,13,15H,1-5,12H2,(H,25,28)