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

Systemtic Name: (2S)-2-[[4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide Openeye Name: (2S)-2-[[4-phenethyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide CAS Name: (2S)-2-[[4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-N-phenylpropanamide IUPAC Name: (2S)-2-[[4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylpropanamide Traditional Name: (2S)-2-[[4-phenethyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]-N-phenyl-propionamide Formula: C24H24N4OS2 MolecularWeight: 448.60356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SC2=NN=C(N2CCC3=CC=CC=C3)CC4=CC=CS4

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1)SC2=NN=C(N2CCC3=CC=CC=C3)CC4=CC=CS4

InChI

InChI=1S/C24H24N4OS2/c1-18(23(29)25-20-11-6-3-7-12-20)31-24-27-26-22(17-21-13-8-16-30-21)28(24)15-14-19-9-4-2-5-10-19/h2-13,16,18H,14-15,17H2,1H3,(H,25,29)/t18-/m0/s1