(3S)-3-[4-(4-phenyl-1,2,3-triazol-1-yl)piperidin-1-yl]carbonylpiperidine-1-carboxamide

Systemtic Name: (3S)-3-[4-(4-phenyl-1,2,3-triazol-1-yl)piperidin-1-yl]carbonylpiperidine-1-carboxamide Openeye Name: (3S)-3-[4-(4-phenyltriazol-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide CAS Name: (3S)-3-[oxo-[4-(4-phenyl-1-triazolyl)-1-piperidinyl]methyl]-1-piperidinecarboxamide IUPAC Name: (3S)-3-[4-(4-phenyltriazol-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide Traditional Name: (3S)-3-[4-(4-phenyltriazol-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide Formula: C20H26N6O2 MolecularWeight: 382.45944

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)N)C(=O)N2CCC(CC2)N3C=C(N=N3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)N)C(=O)N2CCC(CC2)N3C=C(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C20H26N6O2/c21-20(28)25-10-4-7-16(13-25)19(27)24-11-8-17(9-12-24)26-14-18(22-23-26)15-5-2-1-3-6-15/h1-3,5-6,14,16-17H,4,7-13H2,(H2,21,28)/t16-/m0/s1