1-(4-bromophenyl)-3-cyclohexylsulfanyl-3-(4-nitrophenyl)propan-1-one

Systemtic Name: 1-(4-bromophenyl)-3-cyclohexylsulfanyl-3-(4-nitrophenyl)propan-1-one Openeye Name: 1-(4-bromophenyl)-3-cyclohexylsulfanyl-3-(4-nitrophenyl)propan-1-one CAS Name: 1-(4-bromophenyl)-3-(cyclohexylthio)-3-(4-nitrophenyl)-1-propanone IUPAC Name: 1-(4-bromophenyl)-3-cyclohexylsulfanyl-3-(4-nitrophenyl)propan-1-one Traditional Name: 1-(4-bromophenyl)-3-(cyclohexylthio)-3-(4-nitrophenyl)propan-1-one Formula: C21H22BrNO3S MolecularWeight: 448.37328

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC(CC(=O)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)SC(CC(=O)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H22BrNO3S/c22-17-10-6-15(7-11-17)20(24)14-21(27-19-4-2-1-3-5-19)16-8-12-18(13-9-16)23(25)26/h6-13,19,21H,1-5,14H2