ethyl 2-(1,3-benzodioxol-5-ylcarbonylamino)-4-methyl-5-piperidin-1-ylcarbonyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(1,3-benzodioxol-5-ylcarbonylamino)-4-methyl-5-piperidin-1-ylcarbonyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(1,3-benzodioxole-5-carbonylamino)-4-methyl-5-(piperidine-1-carbonyl)thiophene-3-carboxylate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-4-methyl-5-[oxo(1-piperidinyl)methyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzodioxole-5-carbonylamino)-4-methyl-5-(piperidine-1-carbonyl)thiophene-3-carboxylate Traditional Name: 4-methyl-5-(piperidine-1-carbonyl)-2-(piperonyloylamino)thiophene-3-carboxylic acid ethyl ester Formula: C22H24N2O6S MolecularWeight: 444.50076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N2CCCCC2)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N2CCCCC2)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H24N2O6S/c1-3-28-22(27)17-13(2)18(21(26)24-9-5-4-6-10-24)31-20(17)23-19(25)14-7-8-15-16(11-14)30-12-29-15/h7-8,11H,3-6,9-10,12H2,1-2H3,(H,23,25)