[2,6-bis(4-chlorophenyl)thian-4-yl] methanesulfonate

Systemtic Name: [2,6-bis(4-chlorophenyl)thian-4-yl] methanesulfonate Openeye Name: [2,6-bis(4-chlorophenyl)tetrahydrothiopyran-4-yl] methanesulfonate CAS Name: methanesulfonic acid [2,6-bis(4-chlorophenyl)-4-thianyl] ester IUPAC Name: [2,6-bis(4-chlorophenyl)thian-4-yl] methanesulfonate Traditional Name: methanesulfonic acid [2,6-bis(4-chlorophenyl)tetrahydrothiopyran-4-yl] ester Formula: C18H18Cl2O3S2 MolecularWeight: 417.36972

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CC(SC(C1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl

Isomeric SMILES

CS(=O)(=O)OC1CC(SC(C1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18Cl2O3S2/c1-25(21,22)23-16-10-17(12-2-6-14(19)7-3-12)24-18(11-16)13-4-8-15(20)9-5-13/h2-9,16-18H,10-11H2,1H3