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

Systemtic Name: (2S)-N-ethyl-2-[[4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: (2S)-N-ethyl-2-[[4-(2-furylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2S)-N-ethyl-2-[[4-(2-furanylmethyl)-5-phenyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2S)-N-ethyl-2-[[4-(furan-2-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: (2S)-N-ethyl-2-[[4-(2-furfuryl)-5-phenyl-1,2,4-triazol-3-yl]thio]propionamide Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)SC1=NN=C(N1CC2=CC=CO2)C3=CC=CC=C3

Isomeric SMILES

CCNC(=O)[C@H](C)SC1=NN=C(N1CC2=CC=CO2)C3=CC=CC=C3

InChI

InChI=1S/C18H20N4O2S/c1-3-19-17(23)13(2)25-18-21-20-16(14-8-5-4-6-9-14)22(18)12-15-10-7-11-24-15/h4-11,13H,3,12H2,1-2H3,(H,19,23)/t13-/m0/s1