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

Systemtic Name: 4-(1-benzofuran-2-yl)-N-(4-methylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-2-imine Openeye Name: 4-(benzofuran-2-yl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-N-(p-tolyl)thiazol-2-imine CAS Name: 4-(2-benzofuranyl)-N-(4-methylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-thiazolimine IUPAC Name: 4-(1-benzofuran-2-yl)-N-(4-methylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-2-imine Traditional Name: [4-(benzofuran-2-yl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-thiazolin-2-ylidene]-(p-tolyl)amine Formula: C26H18N4O5S MolecularWeight: 498.50992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC4=CC=CC=C4O3)N=CC5=CC6=C(C=C5[N+](=O)[O-])OCO6

Isomeric SMILES

CC1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC4=CC=CC=C4O3)N=CC5=CC6=C(C=C5[N+](=O)[O-])OCO6

InChI

InChI=1S/C26H18N4O5S/c1-16-6-8-19(9-7-16)28-26-29(21(14-36-26)23-10-17-4-2-3-5-22(17)35-23)27-13-18-11-24-25(34-15-33-24)12-20(18)30(31)32/h2-14H,15H2,1H3