4-tert-butyl-1-methyl-2-[(4-nitrophenyl)methylsulfanyl]benzene

Systemtic Name: 4-tert-butyl-1-methyl-2-[(4-nitrophenyl)methylsulfanyl]benzene Openeye Name: 4-tert-butyl-1-methyl-2-[(4-nitrophenyl)methylsulfanyl]benzene CAS Name: 4-tert-butyl-1-methyl-2-[(4-nitrophenyl)methylthio]benzene IUPAC Name: 4-tert-butyl-1-methyl-2-[(4-nitrophenyl)methylsulfanyl]benzene Traditional Name: 4-tert-butyl-1-methyl-2-[(4-nitrobenzyl)thio]benzene Formula: C18H21NO2S MolecularWeight: 315.42984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)SCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)SCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H21NO2S/c1-13-5-8-15(18(2,3)4)11-17(13)22-12-14-6-9-16(10-7-14)19(20)21/h5-11H,12H2,1-4H3