N-(1,3-benzodioxol-5-ylmethyl)-2-(4-phenylsulfanylbutanoylamino)benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-phenylsulfanylbutanoylamino)benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-phenylsulfanylbutanoylamino)benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[1-oxo-4-(phenylthio)butyl]amino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-phenylsulfanylbutanoylamino)benzamide Traditional Name: 2-[4-(phenylthio)butanoylamino]-N-piperonyl-benzamide Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3NC(=O)CCCSC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3NC(=O)CCCSC4=CC=CC=C4

InChI

InChI=1S/C25H24N2O4S/c28-24(11-6-14-32-19-7-2-1-3-8-19)27-21-10-5-4-9-20(21)25(29)26-16-18-12-13-22-23(15-18)31-17-30-22/h1-5,7-10,12-13,15H,6,11,14,16-17H2,(H,26,29)(H,27,28)