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

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-N-ethyl-4-(4-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: 3-(1,3-benzodioxol-5-ylmethyleneamino)-N-ethyl-4-(4-nitrophenyl)thiazol-2-imine CAS Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-N-ethyl-4-(4-nitrophenyl)-2-thiazolimine IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-N-ethyl-4-(4-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: ethyl-[4-(4-nitrophenyl)-3-(piperonylideneamino)-4-thiazolin-2-ylidene]amine Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C1N(C(=CS1)C2=CC=C(C=C2)[N+](=O)[O-])N=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN=C1N(C(=CS1)C2=CC=C(C=C2)[N+](=O)[O-])N=CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H16N4O4S/c1-2-20-19-22(21-10-13-3-8-17-18(9-13)27-12-26-17)16(11-28-19)14-4-6-15(7-5-14)23(24)25/h3-11H,2,12H2,1H3