(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 5-chloranyl-2-piperidin-1-yl-pyrimidine-4-carboxylate

Systemtic Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 5-chloranyl-2-piperidin-1-yl-pyrimidine-4-carboxylate Openeye Name: [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl 5-chloro-2-(1-piperidyl)pyrimidine-4-carboxylate CAS Name: 5-chloro-2-(1-piperidinyl)-4-pyrimidinecarboxylic acid [3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 5-chloro-2-piperidin-1-ylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-piperidino-pyrimidine-4-carboxylic acid [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C17H16ClN5O3S MolecularWeight: 405.85864

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=C(C(=N2)C(=O)OCC3=NC(=NO3)C4=CSC=C4)Cl

Isomeric SMILES

C1CCN(CC1)C2=NC=C(C(=N2)C(=O)OCC3=NC(=NO3)C4=CSC=C4)Cl

InChI

InChI=1S/C17H16ClN5O3S/c18-12-8-19-17(23-5-2-1-3-6-23)21-14(12)16(24)25-9-13-20-15(22-26-13)11-4-7-27-10-11/h4,7-8,10H,1-3,5-6,9H2