3-(1,3-benzodioxol-5-yl)-N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(4-chlorophenyl)methylthio]ethyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(4-chlorobenzyl)thio]ethyl]propionamide Formula: C19H20ClNO3S MolecularWeight: 377.885

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCC(=O)NCCSCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCC(=O)NCCSCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H20ClNO3S/c20-16-5-1-15(2-6-16)12-25-10-9-21-19(22)8-4-14-3-7-17-18(11-14)24-13-23-17/h1-3,5-7,11H,4,8-10,12-13H2,(H,21,22)