N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(1,3-benzothiazol-2-ylsulfanyl)ethanamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(1,3-benzothiazol-2-ylsulfanyl)ethanamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(1,3-benzothiazol-2-ylsulfanyl)acetamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(1,3-benzothiazol-2-ylthio)acetamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(1,3-benzothiazol-2-ylsulfanyl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-homopiperonyl-acetamide Formula: C18H16N2O3S2 MolecularWeight: 372.46124

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H16N2O3S2/c21-17(10-24-18-20-13-3-1-2-4-16(13)25-18)19-8-7-12-5-6-14-15(9-12)23-11-22-14/h1-6,9H,7-8,10-11H2,(H,19,21)