1-chloranyl-6-ethoxy-5-propylsulfanyl-isoquinoline

Systemtic Name: 1-chloranyl-6-ethoxy-5-propylsulfanyl-isoquinoline Openeye Name: 1-chloro-6-ethoxy-5-propylsulfanyl-isoquinoline CAS Name: 1-chloro-6-ethoxy-5-(propylthio)isoquinoline IUPAC Name: 1-chloro-6-ethoxy-5-propylsulfanylisoquinoline Traditional Name: 1-chloro-6-ethoxy-5-(propylthio)isoquinoline Formula: C14H16ClNOS MolecularWeight: 281.80094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C=CC2=C1C=CN=C2Cl)OCC

Isomeric SMILES

CCCSC1=C(C=CC2=C1C=CN=C2Cl)OCC

InChI

InChI=1S/C14H16ClNOS/c1-3-9-18-13-10-7-8-16-14(15)11(10)5-6-12(13)17-4-2/h5-8H,3-4,9H2,1-2H3