3-(1,3-benzodioxol-5-ylmethylideneamino)-4-(furan-2-yl)-N-(2-nitrophenyl)-1,3-thiazol-2-imine

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-4-(furan-2-yl)-N-(2-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: 3-(1,3-benzodioxol-5-ylmethyleneamino)-4-(2-furyl)-N-(2-nitrophenyl)thiazol-2-imine CAS Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-4-(2-furanyl)-N-(2-nitrophenyl)-2-thiazolimine IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-4-(furan-2-yl)-N-(2-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: [4-(2-furyl)-2-(2-nitrophenyl)imino-4-thiazolin-3-yl]-piperonylidene-amine Formula: C21H14N4O5S MolecularWeight: 434.42466

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NN3C(=CSC3=NC4=CC=CC=C4[N+](=O)[O-])C5=CC=CO5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C=NN3C(=CSC3=NC4=CC=CC=C4[N+](=O)[O-])C5=CC=CO5

InChI

InChI=1S/C21H14N4O5S/c26-25(27)16-5-2-1-4-15(16)23-21-24(17(12-31-21)18-6-3-9-28-18)22-11-14-7-8-19-20(10-14)30-13-29-19/h1-12H,13H2