N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]isoquinolin-5-amine

Systemtic Name: N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]isoquinolin-5-amine Openeye Name: N-[[5-(methylsulfanylmethyl)-2-furyl]methyl]isoquinolin-5-amine CAS Name: N-[[5-[(methylthio)methyl]-2-furanyl]methyl]-5-isoquinolinamine IUPAC Name: N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]isoquinolin-5-amine Traditional Name: 5-isoquinolyl-[[5-[(methylthio)methyl]-2-furyl]methyl]amine Formula: C16H16N2OS MolecularWeight: 284.37604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(O1)CNC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CSCC1=CC=C(O1)CNC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C16H16N2OS/c1-20-11-14-6-5-13(19-14)10-18-16-4-2-3-12-9-17-8-7-15(12)16/h2-9,18H,10-11H2,1H3