methyl 1-pyridin-3-ylcarbonyl-4-(thiophen-2-ylmethyl)piperazine-2-carboxylate

Systemtic Name: methyl 1-pyridin-3-ylcarbonyl-4-(thiophen-2-ylmethyl)piperazine-2-carboxylate Openeye Name: methyl 1-(pyridine-3-carbonyl)-4-(2-thienylmethyl)piperazine-2-carboxylate CAS Name: 1-[oxo(3-pyridinyl)methyl]-4-(thiophen-2-ylmethyl)-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 1-(pyridine-3-carbonyl)-4-(thiophen-2-ylmethyl)piperazine-2-carboxylate Traditional Name: 1-nicotinoyl-4-(2-thenyl)piperazine-2-carboxylic acid methyl ester Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCN1C(=O)C2=CN=CC=C2)CC3=CC=CS3

Isomeric SMILES

COC(=O)C1CN(CCN1C(=O)C2=CN=CC=C2)CC3=CC=CS3

InChI

InChI=1S/C17H19N3O3S/c1-23-17(22)15-12-19(11-14-5-3-9-24-14)7-8-20(15)16(21)13-4-2-6-18-10-13/h2-6,9-10,15H,7-8,11-12H2,1H3