methyl 2-[(1-butylsulfonylpiperidin-4-yl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(1-butylsulfonylpiperidin-4-yl)carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(1-butylsulfonylpiperidine-4-carbonyl)amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[(1-butylsulfonyl-4-piperidinyl)-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(1-butylsulfonylpiperidine-4-carbonyl)amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(1-butylsulfonylisonipecotoyl)amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C18H28N2O5S2 MolecularWeight: 416.55532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCC(CC1)C(=O)NC2=C(C(=C(S2)C)C)C(=O)OC

Isomeric SMILES

CCCCS(=O)(=O)N1CCC(CC1)C(=O)NC2=C(C(=C(S2)C)C)C(=O)OC

InChI

InChI=1S/C18H28N2O5S2/c1-5-6-11-27(23,24)20-9-7-14(8-10-20)16(21)19-17-15(18(22)25-4)12(2)13(3)26-17/h14H,5-11H2,1-4H3,(H,19,21)