2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-(2-pyridin-2-ylsulfanylethyl)ethanamide

Systemtic Name: 2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-(2-pyridin-2-ylsulfanylethyl)ethanamide Openeye Name: 2-(5-chloro-2-methyl-N-methylsulfonyl-anilino)-N-[2-(2-pyridylsulfanyl)ethyl]acetamide CAS Name: 2-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[2-(2-pyridinylthio)ethyl]acetamide IUPAC Name: 2-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-(2-pyridin-2-ylsulfanylethyl)acetamide Traditional Name: 2-(5-chloro-N-mesyl-2-methyl-anilino)-N-[2-(2-pyridylthio)ethyl]acetamide Formula: C17H20ClN3O3S2 MolecularWeight: 413.942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(CC(=O)NCCSC2=CC=CC=N2)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(CC(=O)NCCSC2=CC=CC=N2)S(=O)(=O)C

InChI

InChI=1S/C17H20ClN3O3S2/c1-13-6-7-14(18)11-15(13)21(26(2,23)24)12-16(22)19-9-10-25-17-5-3-4-8-20-17/h3-8,11H,9-10,12H2,1-2H3,(H,19,22)