N-(1,3-benzodioxol-5-ylmethyl)-2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(4-fluoroanilino)-2-oxoethyl]thio]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanylbenzamide Traditional Name: 2-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]-N-piperonyl-benzamide Formula: C23H19FN2O4S MolecularWeight: 438.471363

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3SCC(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3SCC(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C23H19FN2O4S/c24-16-6-8-17(9-7-16)26-22(27)13-31-21-4-2-1-3-18(21)23(28)25-12-15-5-10-19-20(11-15)30-14-29-19/h1-11H,12-14H2,(H,25,28)(H,26,27)