2-methyl-7-[4-(thiophen-2-ylmethylcarbamoyl)piperidin-1-yl]sulfonyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid

Systemtic Name: 2-methyl-7-[4-(thiophen-2-ylmethylcarbamoyl)piperidin-1-yl]sulfonyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid Openeye Name: 2-methyl-7-[[4-(2-thienylmethylcarbamoyl)-1-piperidyl]sulfonyl]-1,2,3,4-tetrahydroacridine-9-carboxylic acid CAS Name: 2-methyl-7-[[4-[oxo-(thiophen-2-ylmethylamino)methyl]-1-piperidinyl]sulfonyl]-1,2,3,4-tetrahydroacridine-9-carboxylic acid IUPAC Name: 2-methyl-7-[4-(thiophen-2-ylmethylcarbamoyl)piperidin-1-yl]sulfonyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid Traditional Name: 2-methyl-7-[4-(2-thenylcarbamoyl)piperidino]sulfonyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid Formula: C26H29N3O5S2 MolecularWeight: 527.65556

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=C3C=C(C=CC3=N2)S(=O)(=O)N4CCC(CC4)C(=O)NCC5=CC=CS5)C(=O)O

Isomeric SMILES

CC1CCC2=C(C1)C(=C3C=C(C=CC3=N2)S(=O)(=O)N4CCC(CC4)C(=O)NCC5=CC=CS5)C(=O)O

InChI

InChI=1S/C26H29N3O5S2/c1-16-4-6-22-20(13-16)24(26(31)32)21-14-19(5-7-23(21)28-22)36(33,34)29-10-8-17(9-11-29)25(30)27-15-18-3-2-12-35-18/h2-3,5,7,12,14,16-17H,4,6,8-11,13,15H2,1H3,(H,27,30)(H,31,32)