methyl 2-[4-[(3-methylthiophen-2-yl)methylcarbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[(3-methylthiophen-2-yl)methylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[(3-methyl-2-thienyl)methylcarbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[[(3-methyl-2-thiophenyl)methylamino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[(3-methylthiophen-2-yl)methylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[(3-methyl-2-thienyl)methylcarbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C20H24N2O5S2 MolecularWeight: 436.54496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=C(SC=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C20H24N2O5S2/c1-14-9-12-28-17(14)13-21-19(23)15-7-10-22(11-8-15)29(25,26)18-6-4-3-5-16(18)20(24)27-2/h3-6,9,12,15H,7-8,10-11,13H2,1-2H3,(H,21,23)