2-(1,3-benzodioxol-5-ylmethyl)-N-[3-(1,3-benzodioxol-5-yl)phenyl]-3-sulfanyl-propanamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-[3-(1,3-benzodioxol-5-yl)phenyl]-3-sulfanyl-propanamide Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-[3-(1,3-benzodioxol-5-yl)phenyl]-3-sulfanyl-propanamide CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-[3-(1,3-benzodioxol-5-yl)phenyl]-3-mercaptopropanamide IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-[3-(1,3-benzodioxol-5-yl)phenyl]-3-sulfanylpropanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[3-(1,3-benzodioxol-5-yl)phenyl]-2-(mercaptomethyl)propionamide Formula: C24H21NO5S MolecularWeight: 435.49224

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CC(CS)C(=O)NC3=CC=CC(=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CC(CS)C(=O)NC3=CC=CC(=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H21NO5S/c26-24(18(12-31)8-15-4-6-20-22(9-15)29-13-27-20)25-19-3-1-2-16(10-19)17-5-7-21-23(11-17)30-14-28-21/h1-7,9-11,18,31H,8,12-14H2,(H,25,26)