2-(3,5-dimethoxyphenyl)propan-2-yl N-[(3-methylsulfonyl-6,7-dihydro-2-benzothiophen-1-yl)carbonylamino]carbamate

Systemtic Name: 2-(3,5-dimethoxyphenyl)propan-2-yl N-[(3-methylsulfonyl-6,7-dihydro-2-benzothiophen-1-yl)carbonylamino]carbamate Openeye Name: [1-(3,5-dimethoxyphenyl)-1-methyl-ethyl] N-[(3-methylsulfonyl-6,7-dihydro-2-benzothiophene-1-carbonyl)amino]carbamate CAS Name: N-[[(3-methylsulfonyl-6,7-dihydro-2-benzothiophen-1-yl)-oxomethyl]amino]carbamic acid 2-(3,5-dimethoxyphenyl)propan-2-yl ester IUPAC Name: 2-(3,5-dimethoxyphenyl)propan-2-yl N-[(3-methylsulfonyl-6,7-dihydro-2-benzothiophene-1-carbonyl)amino]carbamate Traditional Name: N-[(3-mesyl-6,7-dihydroisobenzothiophene-1-carbonyl)amino]carbamic acid [1-(3,5-dimethoxyphenyl)-1-methyl-ethyl] ester Formula: C22H26N2O7S2 MolecularWeight: 494.58104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC(=CC(=C1)OC)OC)OC(=O)NNC(=O)C2=C3CCC=CC3=C(S2)S(=O)(=O)C

Isomeric SMILES

CC(C)(C1=CC(=CC(=C1)OC)OC)OC(=O)NNC(=O)C2=C3CCC=CC3=C(S2)S(=O)(=O)C

InChI

InChI=1S/C22H26N2O7S2/c1-22(2,13-10-14(29-3)12-15(11-13)30-4)31-21(26)24-23-19(25)18-16-8-6-7-9-17(16)20(32-18)33(5,27)28/h7,9-12H,6,8H2,1-5H3,(H,23,25)(H,24,26)