N-[(3S)-1-(1H-1,2,4-triazol-5-ylmethyl)pyrrolidin-3-yl]piperidine-2-carboxamide

Systemtic Name: N-[(3S)-1-(1H-1,2,4-triazol-5-ylmethyl)pyrrolidin-3-yl]piperidine-2-carboxamide Openeye Name: N-[(3S)-1-(1H-1,2,4-triazol-5-ylmethyl)pyrrolidin-3-yl]piperidine-2-carboxamide CAS Name: N-[(3S)-1-(1H-1,2,4-triazol-5-ylmethyl)-3-pyrrolidinyl]-2-piperidinecarboxamide IUPAC Name: N-[(3S)-1-(1H-1,2,4-triazol-5-ylmethyl)pyrrolidin-3-yl]piperidine-2-carboxamide Traditional Name: N-[(3S)-1-(1H-1,2,4-triazol-5-ylmethyl)pyrrolidin-3-yl]pipecolinamide Formula: C13H22N6O MolecularWeight: 278.35338

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(C1)C(=O)NC2CCN(C2)CC3=NC=NN3

Isomeric SMILES

C1CCNC(C1)C(=O)N[C@H]2CCN(C2)CC3=NC=NN3

InChI

InChI=1S/C13H22N6O/c20-13(11-3-1-2-5-14-11)17-10-4-6-19(7-10)8-12-15-9-16-18-12/h9-11,14H,1-8H2,(H,17,20)(H,15,16,18)/t10-,11?/m0/s1