2-(1,3-benzodioxol-5-ylmethylsulfanyl)-N-[(1R)-1-(4-bromophenyl)ethyl]ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-N-[(1R)-1-(4-bromophenyl)ethyl]ethanamide Openeye Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-N-[(1R)-1-(4-bromophenyl)ethyl]acetamide CAS Name: 2-(1,3-benzodioxol-5-ylmethylthio)-N-[(1R)-1-(4-bromophenyl)ethyl]acetamide IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylsulfanyl)-N-[(1R)-1-(4-bromophenyl)ethyl]acetamide Traditional Name: N-[(1R)-1-(4-bromophenyl)ethyl]-2-(piperonylthio)acetamide Formula: C18H18BrNO3S MolecularWeight: 408.30942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC(=O)CSCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)Br)NC(=O)CSCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H18BrNO3S/c1-12(14-3-5-15(19)6-4-14)20-18(21)10-24-9-13-2-7-16-17(8-13)23-11-22-16/h2-8,12H,9-11H2,1H3,(H,20,21)/t12-/m1/s1