(2S,4R)-N-tert-butyl-4-(2,6-dimethylpyrimidin-4-yl)sulfanyl-piperidine-2-carboxamide

Systemtic Name: (2S,4R)-N-tert-butyl-4-(2,6-dimethylpyrimidin-4-yl)sulfanyl-piperidine-2-carboxamide Openeye Name: (2S,4R)-N-tert-butyl-4-(2,6-dimethylpyrimidin-4-yl)sulfanyl-piperidine-2-carboxamide CAS Name: (2S,4R)-N-tert-butyl-4-[(2,6-dimethyl-4-pyrimidinyl)thio]-2-piperidinecarboxamide IUPAC Name: (2S,4R)-N-tert-butyl-4-(2,6-dimethylpyrimidin-4-yl)sulfanylpiperidine-2-carboxamide Traditional Name: (2S,4R)-N-tert-butyl-4-[(2,6-dimethylpyrimidin-4-yl)thio]pipecolinamide Formula: C16H26N4OS MolecularWeight: 322.46884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)SC2CCNC(C2)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC(=NC(=N1)C)S[C@@H]2CCN[C@@H](C2)C(=O)NC(C)(C)C

InChI

InChI=1S/C16H26N4OS/c1-10-8-14(19-11(2)18-10)22-12-6-7-17-13(9-12)15(21)20-16(3,4)5/h8,12-13,17H,6-7,9H2,1-5H3,(H,20,21)/t12-,13+/m1/s1