[3-[2-(acetamidomethyl)thiophen-3-yl]-2,6-dimethyl-phenyl]methyl methanesulfonate

Systemtic Name: [3-[2-(acetamidomethyl)thiophen-3-yl]-2,6-dimethyl-phenyl]methyl methanesulfonate Openeye Name: [3-[2-(acetamidomethyl)-3-thienyl]-2,6-dimethyl-phenyl]methyl methanesulfonate CAS Name: methanesulfonic acid [3-[2-(acetamidomethyl)-3-thiophenyl]-2,6-dimethylphenyl]methyl ester IUPAC Name: [3-[2-(acetamidomethyl)thiophen-3-yl]-2,6-dimethylphenyl]methyl methanesulfonate Traditional Name: methanesulfonic acid [3-[2-(acetamidomethyl)-3-thienyl]-2,6-dimethyl-benzyl] ester Formula: C17H21NO4S2 MolecularWeight: 367.48294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C2=C(SC=C2)CNC(=O)C)C)COS(=O)(=O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C2=C(SC=C2)CNC(=O)C)C)COS(=O)(=O)C

InChI

InChI=1S/C17H21NO4S2/c1-11-5-6-14(12(2)16(11)10-22-24(4,20)21)15-7-8-23-17(15)9-18-13(3)19/h5-8H,9-10H2,1-4H3,(H,18,19)