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

Systemtic Name: 4-(3-chlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-phenethyl-1,3-thiazol-2-imine Openeye Name: 4-(3-chlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-N-phenethyl-thiazol-2-imine CAS Name: 4-(3-chlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-phenethyl-2-thiazolimine IUPAC Name: 4-(3-chlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-phenethyl-1,3-thiazol-2-imine Traditional Name: [4-(3-chlorophenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-thiazolin-2-ylidene]-phenethyl-amine Formula: C25H19ClN4O4S MolecularWeight: 506.96076

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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(=CC=C5)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C25H19ClN4O4S/c26-20-8-4-7-18(11-20)22-15-35-25(27-10-9-17-5-2-1-3-6-17)29(22)28-14-19-12-23-24(34-16-33-23)13-21(19)30(31)32/h1-8,11-15H,9-10,16H2