N-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(1,3-dithiolan-2-yl)phenyl]carbonylamino]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(1,3-dithiolan-2-yl)phenyl]carbonylamino]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[[4-(1,3-dithiolan-2-yl)phenyl]-oxomethyl]amino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]benzamide Traditional Name: 2-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]-N-piperonyl-benzamide Formula: C25H22N2O4S2 MolecularWeight: 478.58318

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H22N2O4S2/c28-23(17-6-8-18(9-7-17)25-32-11-12-33-25)27-20-4-2-1-3-19(20)24(29)26-14-16-5-10-21-22(13-16)31-15-30-21/h1-10,13,25H,11-12,14-15H2,(H,26,29)(H,27,28)