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

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-4-(3-nitrophenyl)-N-(phenylmethyl)-1,3-thiazol-2-imine Openeye Name: 3-(1,3-benzodioxol-5-ylmethyleneamino)-N-benzyl-4-(3-nitrophenyl)thiazol-2-imine CAS Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-4-(3-nitrophenyl)-N-(phenylmethyl)-2-thiazolimine IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-N-benzyl-4-(3-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: benzyl-[4-(3-nitrophenyl)-3-(piperonylideneamino)-4-thiazolin-2-ylidene]amine Formula: C24H18N4O4S MolecularWeight: 458.48912

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NN3C(=CSC3=NCC4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C=NN3C(=CSC3=NCC4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C24H18N4O4S/c29-28(30)20-8-4-7-19(12-20)21-15-33-24(25-13-17-5-2-1-3-6-17)27(21)26-14-18-9-10-22-23(11-18)32-16-31-22/h1-12,14-15H,13,16H2