1-[4-(4-chlorophenyl)-2-[(4-nitrophenyl)methylsulfanyl]butyl]imidazole

Systemtic Name: 1-[4-(4-chlorophenyl)-2-[(4-nitrophenyl)methylsulfanyl]butyl]imidazole Openeye Name: 1-[4-(4-chlorophenyl)-2-[(4-nitrophenyl)methylsulfanyl]butyl]imidazole CAS Name: 1-[4-(4-chlorophenyl)-2-[(4-nitrophenyl)methylthio]butyl]imidazole IUPAC Name: 1-[4-(4-chlorophenyl)-2-[(4-nitrophenyl)methylsulfanyl]butyl]imidazole Traditional Name: 1-[4-(4-chlorophenyl)-2-[(4-nitrobenzyl)thio]butyl]imidazole Formula: C20H20ClN3O2S MolecularWeight: 401.9097

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(CN2C=CN=C2)SCC3=CC=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CCC(CN2C=CN=C2)SCC3=CC=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H20ClN3O2S/c21-18-6-1-16(2-7-18)5-10-20(13-23-12-11-22-15-23)27-14-17-3-8-19(9-4-17)24(25)26/h1-4,6-9,11-12,15,20H,5,10,13-14H2