N-[2-[(4-chlorophenyl)methylsulfanyl]phenyl]-2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[2-[(4-chlorophenyl)methylsulfanyl]phenyl]-2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[2-[(4-chlorophenyl)methylsulfanyl]phenyl]-2-(2-methyl-N-methylsulfonyl-5-nitro-anilino)acetamide CAS Name: N-[2-[(4-chlorophenyl)methylthio]phenyl]-2-(2-methyl-N-methylsulfonyl-5-nitroanilino)acetamide IUPAC Name: N-[2-[(4-chlorophenyl)methylsulfanyl]phenyl]-2-(2-methyl-N-methylsulfonyl-5-nitroanilino)acetamide Traditional Name: N-[2-[(4-chlorobenzyl)thio]phenyl]-2-(N-mesyl-2-methyl-5-nitro-anilino)acetamide Formula: C23H22ClN3O5S2 MolecularWeight: 520.02088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CC=CC=C2SCC3=CC=C(C=C3)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CC=CC=C2SCC3=CC=C(C=C3)Cl)S(=O)(=O)C

InChI

InChI=1S/C23H22ClN3O5S2/c1-16-7-12-19(27(29)30)13-21(16)26(34(2,31)32)14-23(28)25-20-5-3-4-6-22(20)33-15-17-8-10-18(24)11-9-17/h3-13H,14-15H2,1-2H3,(H,25,28)