[4-[3,4-bis(fluoranyl)phenyl]sulfanylquinolin-3-yl]methanamine

Systemtic Name: [4-[3,4-bis(fluoranyl)phenyl]sulfanylquinolin-3-yl]methanamine Openeye Name: [4-(3,4-difluorophenyl)sulfanyl-3-quinolyl]methanamine CAS Name: [4-[(3,4-difluorophenyl)thio]-3-quinolinyl]methanamine IUPAC Name: [4-(3,4-difluorophenyl)sulfanylquinolin-3-yl]methanamine Traditional Name: [4-[(3,4-difluorophenyl)thio]-3-quinolyl]methylamine Formula: C16H12F2N2S MolecularWeight: 302.341686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C=N2)CN)SC3=CC(=C(C=C3)F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C=N2)CN)SC3=CC(=C(C=C3)F)F

InChI

InChI=1S/C16H12F2N2S/c17-13-6-5-11(7-14(13)18)21-16-10(8-19)9-20-15-4-2-1-3-12(15)16/h1-7,9H,8,19H2