3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-(3-nitrophenyl)-N-(4-propan-2-ylphenyl)-1,3-thiazol-2-imine

Systemtic Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-(3-nitrophenyl)-N-(4-propan-2-ylphenyl)-1,3-thiazol-2-imine Openeye Name: N-(4-isopropylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-(3-nitrophenyl)thiazol-2-imine CAS Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-(3-nitrophenyl)-N-(4-propan-2-ylphenyl)-2-thiazolimine IUPAC Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-4-(3-nitrophenyl)-N-(4-propan-2-ylphenyl)-1,3-thiazol-2-imine Traditional Name: (6-nitro-1,3-benzodioxol-5-yl)methylene-[4-(3-nitrophenyl)-2-p-cumenylimino-4-thiazolin-3-yl]amine Formula: C26H21N5O6S MolecularWeight: 531.53984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H21N5O6S/c1-16(2)17-6-8-20(9-7-17)28-26-29(23(14-38-26)18-4-3-5-21(10-18)30(32)33)27-13-19-11-24-25(37-15-36-24)12-22(19)31(34)35/h3-14,16H,15H2,1-2H3