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

Systemtic Name: 4-(2-methoxyphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-(phenylmethyl)-1,3-thiazol-2-imine Openeye Name: N-benzyl-4-(2-methoxyphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]thiazol-2-imine CAS Name: 4-(2-methoxyphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-N-(phenylmethyl)-2-thiazolimine IUPAC Name: N-benzyl-4-(2-methoxyphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-1,3-thiazol-2-imine Traditional Name: benzyl-[4-(2-methoxyphenyl)-3-[(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-thiazolin-2-ylidene]amine Formula: C25H20N4O5S MolecularWeight: 488.5151

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CSC(=NCC3=CC=CC=C3)N2N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5

Isomeric SMILES

COC1=CC=CC=C1C2=CSC(=NCC3=CC=CC=C3)N2N=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5

InChI

InChI=1S/C25H20N4O5S/c1-32-22-10-6-5-9-19(22)21-15-35-25(26-13-17-7-3-2-4-8-17)28(21)27-14-18-11-23-24(34-16-33-23)12-20(18)29(30)31/h2-12,14-15H,13,16H2,1H3