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

Systemtic Name: 4-(1-benzofuran-2-yl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-phenethyl-1,3-thiazol-2-imine Openeye Name: 4-(benzofuran-2-yl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-N-phenethyl-thiazol-2-imine CAS Name: 4-(2-benzofuranyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-phenethyl-2-thiazolimine IUPAC Name: 4-(1-benzofuran-2-yl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-phenethyl-1,3-thiazol-2-imine Traditional Name: [4-(benzofuran-2-yl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-thiazolin-2-ylidene]-phenethyl-amine Formula: C27H20N4O5S MolecularWeight: 512.5365

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NN3C(=CSC3=NCCC4=CC=CC=C4)C5=CC6=CC=CC=C6O5)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C=NN3C(=CSC3=NCCC4=CC=CC=C4)C5=CC6=CC=CC=C6O5)[N+](=O)[O-]

InChI

InChI=1S/C27H20N4O5S/c32-31(33)21-14-26-25(34-17-35-26)13-20(21)15-29-30-22(24-12-19-8-4-5-9-23(19)36-24)16-37-27(30)28-11-10-18-6-2-1-3-7-18/h1-9,12-16H,10-11,17H2