methyl 1-[[1-(5-methylthiophen-2-yl)sulfonylpiperidin-3-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[1-(5-methylthiophen-2-yl)sulfonylpiperidin-3-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carbonyl]amino]cyclohexanecarboxylate CAS Name: 1-[[[1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[1-[(5-methyl-2-thienyl)sulfonyl]nipecotoyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C19H28N2O5S2 MolecularWeight: 428.56602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC3(CCCCC3)C(=O)OC

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC3(CCCCC3)C(=O)OC

InChI

InChI=1S/C19H28N2O5S2/c1-14-8-9-16(27-14)28(24,25)21-12-6-7-15(13-21)17(22)20-19(18(23)26-2)10-4-3-5-11-19/h8-9,15H,3-7,10-13H2,1-2H3,(H,20,22)