(2S)-N-ethyl-2-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]propanamide

Systemtic Name: (2S)-N-ethyl-2-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]propanamide Openeye Name: (2S)-N-ethyl-2-[[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]propanamide CAS Name: (2S)-N-ethyl-2-[[1-oxo-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]ethyl]amino]propanamide IUPAC Name: (2S)-N-ethyl-2-[[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]propanamide Traditional Name: (2S)-N-ethyl-2-[[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetyl]amino]propionamide Formula: C15H19N5O2S MolecularWeight: 333.40866

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)CSC1=NNC(=N1)C2=CC=CC=C2

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)CSC1=NNC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C15H19N5O2S/c1-3-16-14(22)10(2)17-12(21)9-23-15-18-13(19-20-15)11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H,16,22)(H,17,21)(H,18,19,20)/t10-/m0/s1