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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]prop-2-enamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]prop-2-enamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(4-chlorophenyl)methylthio]ethyl]-2-propenamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]prop-2-enamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(4-chlorobenzyl)thio]ethyl]acrylamide Formula: C19H18ClNO3S MolecularWeight: 375.86912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClNO3S/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/h1-8,11H,9-10,12-13H2,(H,21,22)