(2R)-N-(tert-butylcarbamoyl)-2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-(tert-butylcarbamoyl)-2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2R)-N-(tert-butylcarbamoyl)-2-[[4-cyclopropyl-5-(1-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-N-[(tert-butylamino)-oxomethyl]-2-[[4-cyclopropyl-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2R)-N-(tert-butylcarbamoyl)-2-[(4-cyclopropyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-(tert-butylcarbamoyl)-2-[(4-cyclopropyl-5-piperidino-1,2,4-triazol-3-yl)thio]propionamide Formula: C18H30N6O2S MolecularWeight: 394.5348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC(C)(C)C)SC1=NN=C(N1C2CC2)N3CCCCC3

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC(C)(C)C)SC1=NN=C(N1C2CC2)N3CCCCC3

InChI

InChI=1S/C18H30N6O2S/c1-12(14(25)19-15(26)20-18(2,3)4)27-17-22-21-16(24(17)13-8-9-13)23-10-6-5-7-11-23/h12-13H,5-11H2,1-4H3,(H2,19,20,25,26)/t12-/m1/s1