2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2R)-pentan-2-yl]ethanamide

Systemtic Name: 2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2R)-pentan-2-yl]ethanamide Openeye Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(1R)-1-methylbutyl]acetamide CAS Name: 2-[[4-amino-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-[(2R)-pentan-2-yl]acetamide IUPAC Name: 2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2R)-pentan-2-yl]acetamide Traditional Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-[(1R)-1-methylbutyl]acetamide Formula: C14H20N6OS MolecularWeight: 320.4132

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)CSC1=NN=C(N1N)C2=CN=CC=C2

Isomeric SMILES

CCC[C@@H](C)NC(=O)CSC1=NN=C(N1N)C2=CN=CC=C2

InChI

InChI=1S/C14H20N6OS/c1-3-5-10(2)17-12(21)9-22-14-19-18-13(20(14)15)11-6-4-7-16-8-11/h4,6-8,10H,3,5,9,15H2,1-2H3,(H,17,21)/t10-/m1/s1