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

Systemtic Name: (2S)-N-ethyl-N-phenyl-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2S)-N-ethyl-N-phenyl-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2S)-N-ethyl-N-phenyl-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2S)-N-ethyl-N-phenyl-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2S)-N-ethyl-N-phenyl-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C17H18N4OS2 MolecularWeight: 358.48102

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C(C)SC2=NNC(=N2)C3=CC=CS3

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)[C@H](C)SC2=NNC(=N2)C3=CC=CS3

InChI

InChI=1S/C17H18N4OS2/c1-3-21(13-8-5-4-6-9-13)16(22)12(2)24-17-18-15(19-20-17)14-10-7-11-23-14/h4-12H,3H2,1-2H3,(H,18,19,20)/t12-/m0/s1