N-(2-tert-butylsulfanylethyl)-2-chloranyl-4-[(4-methylphenyl)sulfonylamino]benzamide

Systemtic Name: N-(2-tert-butylsulfanylethyl)-2-chloranyl-4-[(4-methylphenyl)sulfonylamino]benzamide Openeye Name: N-(2-tert-butylsulfanylethyl)-2-chloro-4-(p-tolylsulfonylamino)benzamide CAS Name: N-[2-(tert-butylthio)ethyl]-2-chloro-4-[(4-methylphenyl)sulfonylamino]benzamide IUPAC Name: N-(2-tert-butylsulfanylethyl)-2-chloro-4-[(4-methylphenyl)sulfonylamino]benzamide Traditional Name: N-[2-(tert-butylthio)ethyl]-2-chloro-4-(tosylamino)benzamide Formula: C20H25ClN2O3S2 MolecularWeight: 441.0071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)C(=O)NCCSC(C)(C)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)C(=O)NCCSC(C)(C)C)Cl

InChI

InChI=1S/C20H25ClN2O3S2/c1-14-5-8-16(9-6-14)28(25,26)23-15-7-10-17(18(21)13-15)19(24)22-11-12-27-20(2,3)4/h5-10,13,23H,11-12H2,1-4H3,(H,22,24)