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

Systemtic Name: 4-(3,4-dichlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-phenethyl-1,3-thiazol-2-imine Openeye Name: 4-(3,4-dichlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-N-phenethyl-thiazol-2-imine CAS Name: 4-(3,4-dichlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-phenethyl-2-thiazolimine IUPAC Name: 4-(3,4-dichlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-phenethyl-1,3-thiazol-2-imine Traditional Name: [4-(3,4-dichlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-thiazolin-2-ylidene]-phenethyl-amine Formula: C25H18Cl2N4O4S MolecularWeight: 541.40582

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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)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C25H18Cl2N4O4S/c26-19-7-6-17(10-20(19)27)22-14-36-25(28-9-8-16-4-2-1-3-5-16)30(22)29-13-18-11-23-24(35-15-34-23)12-21(18)31(32)33/h1-7,10-14H,8-9,15H2