N-(2-tert-butylsulfanylethyl)-2-[(3-chloranyl-4-methoxy-phenyl)-(4-methylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(2-tert-butylsulfanylethyl)-2-[(3-chloranyl-4-methoxy-phenyl)-(4-methylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(2-tert-butylsulfanylethyl)-2-[3-chloro-4-methoxy-N-(p-tolylsulfonyl)anilino]acetamide CAS Name: N-[2-(tert-butylthio)ethyl]-2-(3-chloro-4-methoxy-N-(4-methylphenyl)sulfonylanilino)acetamide IUPAC Name: N-(2-tert-butylsulfanylethyl)-2-(3-chloro-4-methoxy-N-(4-methylphenyl)sulfonylanilino)acetamide Traditional Name: N-[2-(tert-butylthio)ethyl]-2-(3-chloro-4-methoxy-N-tosyl-anilino)acetamide Formula: C22H29ClN2O4S2 MolecularWeight: 485.05966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29ClN2O4S2/c1-16-6-9-18(10-7-16)31(27,28)25(17-8-11-20(29-5)19(23)14-17)15-21(26)24-12-13-30-22(2,3)4/h6-11,14H,12-13,15H2,1-5H3,(H,24,26)