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

Systemtic Name: 4-(4-fluorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-phenethyl-1,3-thiazol-2-imine Openeye Name: 4-(4-fluorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-N-phenethyl-thiazol-2-imine CAS Name: 4-(4-fluorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-phenethyl-2-thiazolimine IUPAC Name: 4-(4-fluorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-phenethyl-1,3-thiazol-2-imine Traditional Name: [4-(4-fluorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-thiazolin-2-ylidene]-phenethyl-amine Formula: C25H19FN4O4S MolecularWeight: 490.506163

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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=CC=C(C=C5)F)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C25H19FN4O4S/c26-20-8-6-18(7-9-20)22-15-35-25(27-11-10-17-4-2-1-3-5-17)29(22)28-14-19-12-23-24(34-16-33-23)13-21(19)30(31)32/h1-9,12-15H,10-11,16H2