1-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]piperidine-4-carboxylate

Systemtic Name: 1-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: 1-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[5-(4-chlorophenyl)-4-thieno[2,3-d]pyrimidinyl]-4-piperidinecarboxylate IUPAC Name: 1-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]isonipecotate Formula: C18H15ClN3O2S- MolecularWeight: 372.8486

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)[O-])C2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)[O-])C2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H16ClN3O2S/c19-13-3-1-11(2-4-13)14-9-25-17-15(14)16(20-10-21-17)22-7-5-12(6-8-22)18(23)24/h1-4,9-10,12H,5-8H2,(H,23,24)/p-1