[3-[(4-chloranyl-3-methyl-phenyl)sulfonyl-methyl-amino]-2-(6-chloranylpyridin-2-yl)-2-oxidanyl-propyl] methanesulfonate

Systemtic Name: [3-[(4-chloranyl-3-methyl-phenyl)sulfonyl-methyl-amino]-2-(6-chloranylpyridin-2-yl)-2-oxidanyl-propyl] methanesulfonate Openeye Name: [3-[(4-chloro-3-methyl-phenyl)sulfonyl-methyl-amino]-2-(6-chloro-2-pyridyl)-2-hydroxy-propyl] methanesulfonate CAS Name: methanesulfonic acid [3-[(4-chloro-3-methylphenyl)sulfonyl-methylamino]-2-(6-chloro-2-pyridinyl)-2-hydroxypropyl] ester IUPAC Name: [3-[(4-chloro-3-methylphenyl)sulfonyl-methylamino]-2-(6-chloropyridin-2-yl)-2-hydroxypropyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[(4-chloro-3-methyl-phenyl)sulfonyl-methyl-amino]-2-(6-chloro-2-pyridyl)-2-hydroxy-propyl] ester Formula: C17H20Cl2N2O6S2 MolecularWeight: 483.3865

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N(C)CC(COS(=O)(=O)C)(C2=NC(=CC=C2)Cl)O)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N(C)CC(COS(=O)(=O)C)(C2=NC(=CC=C2)Cl)O)Cl

InChI

InChI=1S/C17H20Cl2N2O6S2/c1-12-9-13(7-8-14(12)18)29(25,26)21(2)10-17(22,11-27-28(3,23)24)15-5-4-6-16(19)20-15/h4-9,22H,10-11H2,1-3H3