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

Systemtic Name: 3-[(4-bromophenyl)methylsulfanyl]-1-[(4-nitrophenyl)methyl]indole Openeye Name: 3-[(4-bromophenyl)methylsulfanyl]-1-[(4-nitrophenyl)methyl]indole CAS Name: 3-[(4-bromophenyl)methylthio]-1-[(4-nitrophenyl)methyl]indole IUPAC Name: 3-[(4-bromophenyl)methylsulfanyl]-1-[(4-nitrophenyl)methyl]indole Traditional Name: 3-[(4-bromobenzyl)thio]-1-(4-nitrobenzyl)indole Formula: C22H17BrN2O2S MolecularWeight: 453.35158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17BrN2O2S/c23-18-9-5-17(6-10-18)15-28-22-14-24(21-4-2-1-3-20(21)22)13-16-7-11-19(12-8-16)25(26)27/h1-12,14H,13,15H2