N-(1,3-benzodioxol-5-ylmethyl)-3-methoxy-N-(2-phenylsulfanylethyl)aniline

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methoxy-N-(2-phenylsulfanylethyl)aniline Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methoxy-N-(2-phenylsulfanylethyl)aniline CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methoxy-N-[2-(phenylthio)ethyl]aniline IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methoxy-N-(2-phenylsulfanylethyl)aniline Traditional Name: (3-methoxyphenyl)-[2-(phenylthio)ethyl]-piperonyl-amine Formula: C23H23NO3S MolecularWeight: 393.49862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N(CCSC2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=CC(=C1)N(CCSC2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H23NO3S/c1-25-20-7-5-6-19(15-20)24(12-13-28-21-8-3-2-4-9-21)16-18-10-11-22-23(14-18)27-17-26-22/h2-11,14-15H,12-13,16-17H2,1H3