3-[(3-fluorophenyl)methylsulfanyl]-1-[(4-nitrophenyl)methyl]indole

Systemtic Name: 3-[(3-fluorophenyl)methylsulfanyl]-1-[(4-nitrophenyl)methyl]indole Openeye Name: 3-[(3-fluorophenyl)methylsulfanyl]-1-[(4-nitrophenyl)methyl]indole CAS Name: 3-[(3-fluorophenyl)methylthio]-1-[(4-nitrophenyl)methyl]indole IUPAC Name: 3-[(3-fluorophenyl)methylsulfanyl]-1-[(4-nitrophenyl)methyl]indole Traditional Name: 3-[(3-fluorobenzyl)thio]-1-(4-nitrobenzyl)indole Formula: C22H17FN2O2S MolecularWeight: 392.445983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)[N+](=O)[O-])SCC4=CC(=CC=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)[N+](=O)[O-])SCC4=CC(=CC=C4)F

InChI

InChI=1S/C22H17FN2O2S/c23-18-5-3-4-17(12-18)15-28-22-14-24(21-7-2-1-6-20(21)22)13-16-8-10-19(11-9-16)25(26)27/h1-12,14H,13,15H2