2-[(2,6-dimethylphenyl)-methylsulfonyl-amino]-N-(2-pyridin-2-ylsulfanylethyl)ethanamide

Systemtic Name: 2-[(2,6-dimethylphenyl)-methylsulfonyl-amino]-N-(2-pyridin-2-ylsulfanylethyl)ethanamide Openeye Name: 2-(2,6-dimethyl-N-methylsulfonyl-anilino)-N-[2-(2-pyridylsulfanyl)ethyl]acetamide CAS Name: 2-(2,6-dimethyl-N-methylsulfonylanilino)-N-[2-(2-pyridinylthio)ethyl]acetamide IUPAC Name: 2-(2,6-dimethyl-N-methylsulfonylanilino)-N-(2-pyridin-2-ylsulfanylethyl)acetamide Traditional Name: 2-(N-mesyl-2,6-dimethyl-anilino)-N-[2-(2-pyridylthio)ethyl]acetamide Formula: C18H23N3O3S2 MolecularWeight: 393.52352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O3S2/c1-14-7-6-8-15(2)18(14)21(26(3,23)24)13-16(22)19-11-12-25-17-9-4-5-10-20-17/h4-10H,11-13H2,1-3H3,(H,19,22)