N-[3-(4-chlorophenyl)sulfanylpropyl]-2-[methylsulfonyl-(4-propan-2-ylphenyl)amino]ethanamide

Systemtic Name: N-[3-(4-chlorophenyl)sulfanylpropyl]-2-[methylsulfonyl-(4-propan-2-ylphenyl)amino]ethanamide Openeye Name: N-[3-(4-chlorophenyl)sulfanylpropyl]-2-(4-isopropyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[3-[(4-chlorophenyl)thio]propyl]-2-(N-methylsulfonyl-4-propan-2-ylanilino)acetamide IUPAC Name: N-[3-(4-chlorophenyl)sulfanylpropyl]-2-(N-methylsulfonyl-4-propan-2-ylanilino)acetamide Traditional Name: N-[3-[(4-chlorophenyl)thio]propyl]-2-(4-isopropyl-N-mesyl-anilino)acetamide Formula: C21H27ClN2O3S2 MolecularWeight: 455.03368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N(CC(=O)NCCCSC2=CC=C(C=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N(CC(=O)NCCCSC2=CC=C(C=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H27ClN2O3S2/c1-16(2)17-5-9-19(10-6-17)24(29(3,26)27)15-21(25)23-13-4-14-28-20-11-7-18(22)8-12-20/h5-12,16H,4,13-15H2,1-3H3,(H,23,25)