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

Systemtic Name: 4-(4-methylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-(phenylmethyl)-1,3-thiazol-2-imine Openeye Name: N-benzyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-(p-tolyl)thiazol-2-imine CAS Name: 4-(4-methylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-(phenylmethyl)-2-thiazolimine IUPAC Name: N-benzyl-4-(4-methylphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-2-imine Traditional Name: benzyl-[3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-(p-tolyl)-4-thiazolin-2-ylidene]amine Formula: C25H20N4O4S MolecularWeight: 472.5157

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=NCC3=CC=CC=C3)N2N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=NCC3=CC=CC=C3)N2N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5

InChI

InChI=1S/C25H20N4O4S/c1-17-7-9-19(10-8-17)22-15-34-25(26-13-18-5-3-2-4-6-18)28(22)27-14-20-11-23-24(33-16-32-23)12-21(20)29(30)31/h2-12,14-15H,13,16H2,1H3