3-(1,3-benzodioxol-5-ylmethyl)-N-(2-nitrophenyl)-4-phenyl-1,3-thiazol-2-imine

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-(2-nitrophenyl)-4-phenyl-1,3-thiazol-2-imine Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-(2-nitrophenyl)-4-phenyl-thiazol-2-imine CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-(2-nitrophenyl)-4-phenyl-2-thiazolimine IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-(2-nitrophenyl)-4-phenyl-1,3-thiazol-2-imine Traditional Name: (2-nitrophenyl)-(4-phenyl-3-piperonyl-4-thiazolin-2-ylidene)amine Formula: C23H17N3O4S MolecularWeight: 431.46378

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(=CSC3=NC4=CC=CC=C4[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(=CSC3=NC4=CC=CC=C4[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C23H17N3O4S/c27-26(28)19-9-5-4-8-18(19)24-23-25(20(14-31-23)17-6-2-1-3-7-17)13-16-10-11-21-22(12-16)30-15-29-21/h1-12,14H,13,15H2