N-(4-cyclopentylsulfanylphenyl)-2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(4-cyclopentylsulfanylphenyl)-2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(4-cyclopentylsulfanylphenyl)-2-[methyl(p-tolylsulfonyl)amino]acetamide CAS Name: N-[4-(cyclopentylthio)phenyl]-2-[methyl-(4-methylphenyl)sulfonylamino]acetamide IUPAC Name: N-(4-cyclopentylsulfanylphenyl)-2-[methyl-(4-methylphenyl)sulfonylamino]acetamide Traditional Name: N-[4-(cyclopentylthio)phenyl]-2-[methyl(tosyl)amino]acetamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC=C(C=C2)SC3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC=C(C=C2)SC3CCCC3

InChI

InChI=1S/C21H26N2O3S2/c1-16-7-13-20(14-8-16)28(25,26)23(2)15-21(24)22-17-9-11-19(12-10-17)27-18-5-3-4-6-18/h7-14,18H,3-6,15H2,1-2H3,(H,22,24)