methyl 3-[(2-methyl-5-piperidin-1-ylsulfonyl-furan-3-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(2-methyl-5-piperidin-1-ylsulfonyl-furan-3-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-methyl-5-(1-piperidylsulfonyl)furan-3-carbonyl]amino]thiophene-2-carboxylate CAS Name: 3-[[[2-methyl-5-(1-piperidinylsulfonyl)-3-furanyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-methyl-5-piperidin-1-ylsulfonylfuran-3-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 3-[(2-methyl-5-piperidinosulfonyl-3-furoyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C17H20N2O6S2 MolecularWeight: 412.4805

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)S(=O)(=O)N2CCCCC2)C(=O)NC3=C(SC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)S(=O)(=O)N2CCCCC2)C(=O)NC3=C(SC=C3)C(=O)OC

InChI

InChI=1S/C17H20N2O6S2/c1-11-12(16(20)18-13-6-9-26-15(13)17(21)24-2)10-14(25-11)27(22,23)19-7-4-3-5-8-19/h6,9-10H,3-5,7-8H2,1-2H3,(H,18,20)