N-(2-tert-butylsulfanylethyl)-4-[methylsulfonyl-(phenylmethyl)amino]benzamide

Systemtic Name: N-(2-tert-butylsulfanylethyl)-4-[methylsulfonyl-(phenylmethyl)amino]benzamide Openeye Name: 4-[benzyl(methylsulfonyl)amino]-N-(2-tert-butylsulfanylethyl)benzamide CAS Name: N-[2-(tert-butylthio)ethyl]-4-[methylsulfonyl-(phenylmethyl)amino]benzamide IUPAC Name: 4-[benzyl(methylsulfonyl)amino]-N-(2-tert-butylsulfanylethyl)benzamide Traditional Name: 4-[benzyl(mesyl)amino]-N-[2-(tert-butylthio)ethyl]benzamide Formula: C21H28N2O3S2 MolecularWeight: 420.58862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCCNC(=O)C1=CC=C(C=C1)N(CC2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)SCCNC(=O)C1=CC=C(C=C1)N(CC2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C21H28N2O3S2/c1-21(2,3)27-15-14-22-20(24)18-10-12-19(13-11-18)23(28(4,25)26)16-17-8-6-5-7-9-17/h5-13H,14-16H2,1-4H3,(H,22,24)