3-(1,3-benzodioxol-5-ylmethyl)-4-(2,4-dimethoxyphenyl)-N-(2-nitrophenyl)-1,3-thiazol-2-imine

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-(2,4-dimethoxyphenyl)-N-(2-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-(2,4-dimethoxyphenyl)-N-(2-nitrophenyl)thiazol-2-imine CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-(2,4-dimethoxyphenyl)-N-(2-nitrophenyl)-2-thiazolimine IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-(2,4-dimethoxyphenyl)-N-(2-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: [4-(2,4-dimethoxyphenyl)-3-piperonyl-4-thiazolin-2-ylidene]-(2-nitrophenyl)amine Formula: C25H21N3O6S MolecularWeight: 491.51574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CSC(=NC3=CC=CC=C3[N+](=O)[O-])N2CC4=CC5=C(C=C4)OCO5)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CSC(=NC3=CC=CC=C3[N+](=O)[O-])N2CC4=CC5=C(C=C4)OCO5)OC

InChI

InChI=1S/C25H21N3O6S/c1-31-17-8-9-18(23(12-17)32-2)21-14-35-25(26-19-5-3-4-6-20(19)28(29)30)27(21)13-16-7-10-22-24(11-16)34-15-33-22/h3-12,14H,13,15H2,1-2H3