N-(1,3-benzodioxol-5-ylmethyl)-3-(1H-indol-3-ylmethylsulfanyl)propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(1H-indol-3-ylmethylsulfanyl)propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(1H-indol-3-ylmethylsulfanyl)propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(1H-indol-3-ylmethylthio)propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(1H-indol-3-ylmethylsulfanyl)propanamide Traditional Name: 3-(1H-indol-3-ylmethylthio)-N-piperonyl-propionamide Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCSCC3=CNC4=CC=CC=C43

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCSCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C20H20N2O3S/c23-20(22-10-14-5-6-18-19(9-14)25-13-24-18)7-8-26-12-15-11-21-17-4-2-1-3-16(15)17/h1-6,9,11,21H,7-8,10,12-13H2,(H,22,23)