methyl 3-[[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidin-4-yl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidin-4-yl]carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(1-indan-5-ylsulfonylpiperidine-4-carbonyl)amino]thiophene-2-carboxylate CAS Name: 3-[[[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-piperidinyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carbonyl]amino]thiophene-2-carboxylate Traditional Name: 3-[(1-indan-5-ylsulfonylisonipecotoyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C21H24N2O5S2 MolecularWeight: 448.55566

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C21H24N2O5S2/c1-28-21(25)19-18(9-12-29-19)22-20(24)15-7-10-23(11-8-15)30(26,27)17-6-5-14-3-2-4-16(14)13-17/h5-6,9,12-13,15H,2-4,7-8,10-11H2,1H3,(H,22,24)