8-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]quinoline

Systemtic Name: 8-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]quinoline Openeye Name: 8-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]quinoline CAS Name: 8-[(6-chloro-1,3-benzodioxol-5-yl)methylthio]quinoline IUPAC Name: 8-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]quinoline Traditional Name: 8-[(6-chloro-1,3-benzodioxol-5-yl)methylthio]quinoline Formula: C17H12ClNO2S MolecularWeight: 329.80068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CSC3=CC=CC4=C3N=CC=C4)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CSC3=CC=CC4=C3N=CC=C4)Cl

InChI

InChI=1S/C17H12ClNO2S/c18-13-8-15-14(20-10-21-15)7-12(13)9-22-16-5-1-3-11-4-2-6-19-17(11)16/h1-8H,9-10H2