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

Systemtic Name: 4-(1-benzofuran-2-yl)-N-(4-ethoxyphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-2-imine Openeye Name: 4-(benzofuran-2-yl)-N-(4-ethoxyphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]thiazol-2-imine CAS Name: 4-(2-benzofuranyl)-N-(4-ethoxyphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-thiazolimine IUPAC Name: 4-(1-benzofuran-2-yl)-N-(4-ethoxyphenyl)-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-phenetyl-amine Formula: C27H20N4O6S MolecularWeight: 528.5359

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=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

CCOC1=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/C27H20N4O6S/c1-2-34-20-9-7-19(8-10-20)29-27-30(22(15-38-27)24-11-17-5-3-4-6-23(17)37-24)28-14-18-12-25-26(36-16-35-25)13-21(18)31(32)33/h3-15H,2,16H2,1H3