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

Systemtic Name: 2-[(2-methoxy-5-methyl-phenyl)-methylsulfonyl-amino]-N-(2-pyridin-2-ylsulfanylethyl)ethanamide Openeye Name: 2-(2-methoxy-5-methyl-N-methylsulfonyl-anilino)-N-[2-(2-pyridylsulfanyl)ethyl]acetamide CAS Name: 2-(2-methoxy-5-methyl-N-methylsulfonylanilino)-N-[2-(2-pyridinylthio)ethyl]acetamide IUPAC Name: 2-(2-methoxy-5-methyl-N-methylsulfonylanilino)-N-(2-pyridin-2-ylsulfanylethyl)acetamide Traditional Name: 2-(N-mesyl-2-methoxy-5-methyl-anilino)-N-[2-(2-pyridylthio)ethyl]acetamide Formula: C18H23N3O4S2 MolecularWeight: 409.52292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O4S2/c1-14-7-8-16(25-2)15(12-14)21(27(3,23)24)13-17(22)19-10-11-26-18-6-4-5-9-20-18/h4-9,12H,10-11,13H2,1-3H3,(H,19,22)