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

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(1R)-1-phenylbutyl]ethanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(1R)-1-phenylbutyl]acetamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-[(1R)-1-phenylbutyl]acetamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(1R)-1-phenylbutyl]acetamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-[(1R)-1-phenylbutyl]acetamide Formula: C14H19N5OS MolecularWeight: 305.39856

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)CSC2=NNC(=N2)N

Isomeric SMILES

CCC[C@H](C1=CC=CC=C1)NC(=O)CSC2=NNC(=N2)N

InChI

InChI=1S/C14H19N5OS/c1-2-6-11(10-7-4-3-5-8-10)16-12(20)9-21-14-17-13(15)18-19-14/h3-5,7-8,11H,2,6,9H2,1H3,(H,16,20)(H3,15,17,18,19)/t11-/m1/s1