1-(4-tert-butylphenyl)-2-(2-chloranyl-4-nitro-phenyl)sulfanyl-ethanone

Systemtic Name: 1-(4-tert-butylphenyl)-2-(2-chloranyl-4-nitro-phenyl)sulfanyl-ethanone Openeye Name: 1-(4-tert-butylphenyl)-2-(2-chloro-4-nitro-phenyl)sulfanyl-ethanone CAS Name: 1-(4-tert-butylphenyl)-2-[(2-chloro-4-nitrophenyl)thio]ethanone IUPAC Name: 1-(4-tert-butylphenyl)-2-(2-chloro-4-nitrophenyl)sulfanylethanone Traditional Name: 1-(4-tert-butylphenyl)-2-[(2-chloro-4-nitro-phenyl)thio]ethanone Formula: C18H18ClNO3S MolecularWeight: 363.85842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CSC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CSC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H18ClNO3S/c1-18(2,3)13-6-4-12(5-7-13)16(21)11-24-17-9-8-14(20(22)23)10-15(17)19/h4-10H,11H2,1-3H3