N-(2-tert-butylsulfanylethyl)-2-[(3-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(2-tert-butylsulfanylethyl)-2-[(3-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(2-tert-butylsulfanylethyl)-2-[3-methoxy-N-(p-tolylsulfonyl)anilino]acetamide CAS Name: N-[2-(tert-butylthio)ethyl]-2-(3-methoxy-N-(4-methylphenyl)sulfonylanilino)acetamide IUPAC Name: N-(2-tert-butylsulfanylethyl)-2-(3-methoxy-N-(4-methylphenyl)sulfonylanilino)acetamide Traditional Name: N-[2-(tert-butylthio)ethyl]-2-(3-methoxy-N-tosyl-anilino)acetamide Formula: C22H30N2O4S2 MolecularWeight: 450.6146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCSC(C)(C)C)C2=CC(=CC=C2)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCSC(C)(C)C)C2=CC(=CC=C2)OC

InChI

InChI=1S/C22H30N2O4S2/c1-17-9-11-20(12-10-17)30(26,27)24(18-7-6-8-19(15-18)28-5)16-21(25)23-13-14-29-22(2,3)4/h6-12,15H,13-14,16H2,1-5H3,(H,23,25)