N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-cyanophenyl)methylsulfanyl]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-cyanophenyl)methylsulfanyl]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-cyanophenyl)methylsulfanyl]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-cyanophenyl)methylthio]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-cyanophenyl)methylsulfanyl]benzamide Traditional Name: 2-[(4-cyanobenzyl)thio]-N-piperonyl-benzamide Formula: C23H18N2O3S MolecularWeight: 402.46562

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3SCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3SCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H18N2O3S/c24-12-16-5-7-17(8-6-16)14-29-22-4-2-1-3-19(22)23(26)25-13-18-9-10-20-21(11-18)28-15-27-20/h1-11H,13-15H2,(H,25,26)