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

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-N-(2-nitrophenyl)-4-thiophen-2-yl-1,3-thiazol-2-imine Openeye Name: 3-(1,3-benzodioxol-5-ylmethyleneamino)-N-(2-nitrophenyl)-4-(2-thienyl)thiazol-2-imine CAS Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-N-(2-nitrophenyl)-4-thiophen-2-yl-2-thiazolimine IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-N-(2-nitrophenyl)-4-thiophen-2-yl-1,3-thiazol-2-imine Traditional Name: (2-nitrophenyl)-[3-(piperonylideneamino)-4-(2-thienyl)-4-thiazolin-2-ylidene]amine Formula: C21H14N4O4S2 MolecularWeight: 450.49026

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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=CS5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C=NN3C(=CSC3=NC4=CC=CC=C4[N+](=O)[O-])C5=CC=CS5

InChI

InChI=1S/C21H14N4O4S2/c26-25(27)16-5-2-1-4-15(16)23-21-24(17(12-31-21)20-6-3-9-30-20)22-11-14-7-8-18-19(10-14)29-13-28-18/h1-12H,13H2