6-[2-methylimino-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-methylimino-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-methylimino-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-methylimino-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-methylimino-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-methylimino-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C20H15N5O6S MolecularWeight: 453.428

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Descriptors Computed from Structure

Canonical SMILES:

CN=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5

Isomeric SMILES

CN=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5

InChI

InChI=1S/C20H15N5O6S/c1-21-20-24(22-7-12-5-17-18(31-10-30-17)6-14(12)25(27)28)15(9-32-20)11-2-3-16-13(4-11)23-19(26)8-29-16/h2-7,9H,8,10H2,1H3,(H,23,26)