methyl 3-[(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)sulfonyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)sulfonyl]thiophene-2-carboxylate Openeye Name: methyl 3-[5-(1-piperidylsulfonyl)indolin-1-yl]sulfonylthiophene-2-carboxylate CAS Name: 3-[[5-(1-piperidinylsulfonyl)-2,3-dihydroindol-1-yl]sulfonyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)sulfonyl]thiophene-2-carboxylate Traditional Name: 3-(5-piperidinosulfonylindolin-1-yl)sulfonylthiophene-2-carboxylic acid methyl ester Formula: C19H22N2O6S3 MolecularWeight: 470.58278

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)N2CCC3=C2C=CC(=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)N2CCC3=C2C=CC(=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C19H22N2O6S3/c1-27-19(22)18-17(8-12-28-18)30(25,26)21-11-7-14-13-15(5-6-16(14)21)29(23,24)20-9-3-2-4-10-20/h5-6,8,12-13H,2-4,7,9-11H2,1H3