N-(1,3-benzodioxol-5-ylmethyl)-N-(4-fluorophenyl)-3-nitro-4-pyridin-2-ylsulfanyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(4-fluorophenyl)-3-nitro-4-pyridin-2-ylsulfanyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(4-fluorophenyl)-3-nitro-4-(2-pyridylsulfanyl)benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(4-fluorophenyl)-3-nitro-4-(2-pyridinylthio)benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-(4-fluorophenyl)-3-nitro-4-pyridin-2-ylsulfanylbenzamide Traditional Name: N-(4-fluorophenyl)-3-nitro-N-piperonyl-4-(2-pyridylthio)benzamide Formula: C26H18FN3O5S MolecularWeight: 503.501623

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN(C3=CC=C(C=C3)F)C(=O)C4=CC(=C(C=C4)SC5=CC=CC=N5)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN(C3=CC=C(C=C3)F)C(=O)C4=CC(=C(C=C4)SC5=CC=CC=N5)[N+](=O)[O-]

InChI

InChI=1S/C26H18FN3O5S/c27-19-6-8-20(9-7-19)29(15-17-4-10-22-23(13-17)35-16-34-22)26(31)18-5-11-24(21(14-18)30(32)33)36-25-3-1-2-12-28-25/h1-14H,15-16H2