N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-2-[(2-nitrophenyl)sulfonyl-phenyl-amino]ethanamide

Systemtic Name: N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-2-[(2-nitrophenyl)sulfonyl-phenyl-amino]ethanamide Openeye Name: 2-(N-(2-nitrophenyl)sulfonylanilino)-N-[2-(p-tolylmethylsulfanyl)ethyl]acetamide CAS Name: N-[2-[(4-methylphenyl)methylthio]ethyl]-2-(N-(2-nitrophenyl)sulfonylanilino)acetamide IUPAC Name: N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-2-(N-(2-nitrophenyl)sulfonylanilino)acetamide Traditional Name: N-[2-[(4-methylbenzyl)thio]ethyl]-2-(N-(2-nitrophenyl)sulfonylanilino)acetamide Formula: C24H25N3O5S2 MolecularWeight: 499.6024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCNC(=O)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CSCCNC(=O)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C24H25N3O5S2/c1-19-11-13-20(14-12-19)18-33-16-15-25-24(28)17-26(21-7-3-2-4-8-21)34(31,32)23-10-6-5-9-22(23)27(29)30/h2-14H,15-18H2,1H3,(H,25,28)