(2S)-N-ethyl-2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: (2S)-N-ethyl-2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: (2S)-2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-ethyl-propanamide CAS Name: (2S)-N-ethyl-2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2S)-2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-ethylpropanamide Traditional Name: (2S)-2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-ethyl-propionamide Formula: C15H20N4OS MolecularWeight: 304.4105

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)SC1=NN=C(N1CC2=CC=CC=C2)C

Isomeric SMILES

CCNC(=O)[C@H](C)SC1=NN=C(N1CC2=CC=CC=C2)C

InChI

InChI=1S/C15H20N4OS/c1-4-16-14(20)11(2)21-15-18-17-12(3)19(15)10-13-8-6-5-7-9-13/h5-9,11H,4,10H2,1-3H3,(H,16,20)/t11-/m0/s1