N-(2,6-dimethylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenyl-1,3-thiazol-2-imine

Systemtic Name: N-(2,6-dimethylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenyl-1,3-thiazol-2-imine Openeye Name: N-(2,6-dimethylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-phenyl-thiazol-2-imine CAS Name: N-(2,6-dimethylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenyl-2-thiazolimine IUPAC Name: N-(2,6-dimethylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-phenyl-1,3-thiazol-2-imine Traditional Name: (2,6-dimethylphenyl)-[3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-phenyl-4-thiazolin-2-ylidene]amine Formula: C25H20N4O4S MolecularWeight: 472.5157

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N=C2N(C(=CS2)C3=CC=CC=C3)N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5

Isomeric SMILES

CC1=C(C(=CC=C1)C)N=C2N(C(=CS2)C3=CC=CC=C3)N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5

InChI

InChI=1S/C25H20N4O4S/c1-16-7-6-8-17(2)24(16)27-25-28(21(14-34-25)18-9-4-3-5-10-18)26-13-19-11-22-23(33-15-32-22)12-20(19)29(30)31/h3-14H,15H2,1-2H3