N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-1-pyrimidin-2-yl-piperidine-4-carboxamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-1-pyrimidin-2-yl-piperidine-4-carboxamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-1-pyrimidin-2-yl-piperidine-4-carboxamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-1-(2-pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-1-pyrimidin-2-ylpiperidine-4-carboxamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-1-(2-pyrimidyl)isonipecotamide Formula: C14H20N4O3S MolecularWeight: 324.3986

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2CCS(=O)(=O)C2)C3=NC=CC=N3

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1NC(=O)C2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C14H20N4O3S/c19-13(17-12-4-9-22(20,21)10-12)11-2-7-18(8-3-11)14-15-5-1-6-16-14/h1,5-6,11-12H,2-4,7-10H2,(H,17,19)/t12-/m0/s1