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

Systemtic Name: 2-[methylsulfonyl-(4-propan-2-ylphenyl)amino]-N-(3-phenylsulfanylpropyl)ethanamide Openeye Name: 2-(4-isopropyl-N-methylsulfonyl-anilino)-N-(3-phenylsulfanylpropyl)acetamide CAS Name: 2-(N-methylsulfonyl-4-propan-2-ylanilino)-N-[3-(phenylthio)propyl]acetamide IUPAC Name: 2-(N-methylsulfonyl-4-propan-2-ylanilino)-N-(3-phenylsulfanylpropyl)acetamide Traditional Name: 2-(4-isopropyl-N-mesyl-anilino)-N-[3-(phenylthio)propyl]acetamide Formula: C21H28N2O3S2 MolecularWeight: 420.58862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O3S2/c1-17(2)18-10-12-19(13-11-18)23(28(3,25)26)16-21(24)22-14-7-15-27-20-8-5-4-6-9-20/h4-6,8-13,17H,7,14-16H2,1-3H3,(H,22,24)