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methyl 2-[(4-methoxyphenyl)sulfonylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

methyl 2-[(4-methoxyphenyl)sulfonylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name:methyl 2-[(4-methoxyphenyl)sulfonylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Openeye Name:methyl 6-(1,1-dimethylpropyl)-2-[(4-methoxyphenyl)sulfonylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
CAS Name:2-[(4-methoxyphenyl)sulfonylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester
IUPAC Name:methyl 2-[(4-methoxyphenyl)sulfonylamino]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Traditional Name:6-tert-amyl-2-[(4-methoxyphenyl)sulfonylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester
Formula: C22H29NO5S2
MolecularWeight: 451.59936
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NS(=O)(=O)C3=CC=C(C=C3)OC


Isomeric SMILES

CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NS(=O)(=O)C3=CC=C(C=C3)OC


InChI

InChI=1S/C22H29NO5S2/c1-6-22(2,3)14-7-12-17-18(13-14)29-20(19(17)21(24)28-5)23-30(25,26)16-10-8-15(27-4)9-11-16/h8-11,14,23H,6-7,12-13H2,1-5H3


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