ethyl 2-(1-adamantylcarbonylamino)-4-methyl-5-piperidin-1-ylcarbonyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(1-adamantylcarbonylamino)-4-methyl-5-piperidin-1-ylcarbonyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(adamantane-1-carbonylamino)-4-methyl-5-(piperidine-1-carbonyl)thiophene-3-carboxylate CAS Name: 2-[[1-adamantyl(oxo)methyl]amino]-4-methyl-5-[oxo(1-piperidinyl)methyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(adamantane-1-carbonylamino)-4-methyl-5-(piperidine-1-carbonyl)thiophene-3-carboxylate Traditional Name: 2-(adamantane-1-carbonylamino)-4-methyl-5-(piperidine-1-carbonyl)thiophene-3-carboxylic acid ethyl ester Formula: C25H34N2O4S MolecularWeight: 458.61346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N2CCCCC2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N2CCCCC2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H34N2O4S/c1-3-31-23(29)19-15(2)20(22(28)27-7-5-4-6-8-27)32-21(19)26-24(30)25-12-16-9-17(13-25)11-18(10-16)14-25/h16-18H,3-14H2,1-2H3,(H,26,30)