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

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-N-(2-nitrophenyl)-4-(4-phenylphenyl)-1,3-thiazol-2-imine Openeye Name: 3-(1,3-benzodioxol-5-ylmethyleneamino)-N-(2-nitrophenyl)-4-(4-phenylphenyl)thiazol-2-imine CAS Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-N-(2-nitrophenyl)-4-(4-phenylphenyl)-2-thiazolimine IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-N-(2-nitrophenyl)-4-(4-phenylphenyl)-1,3-thiazol-2-imine Traditional Name: (2-nitrophenyl)-[4-(4-phenylphenyl)-3-(piperonylideneamino)-4-thiazolin-2-ylidene]amine Formula: C29H20N4O4S MolecularWeight: 520.5585

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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=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C=NN3C(=CSC3=NC4=CC=CC=C4[N+](=O)[O-])C5=CC=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C29H20N4O4S/c34-33(35)25-9-5-4-8-24(25)31-29-32(30-17-20-10-15-27-28(16-20)37-19-36-27)26(18-38-29)23-13-11-22(12-14-23)21-6-2-1-3-7-21/h1-18H,19H2