(2R)-2-[[5-(2-fluorophenyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(methylcarbamoyl)propanamide

Systemtic Name: (2R)-2-[[5-(2-fluorophenyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(methylcarbamoyl)propanamide Openeye Name: (2R)-2-[[4-benzyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(methylcarbamoyl)propanamide CAS Name: (2R)-2-[[5-(2-fluorophenyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-N-(methylcarbamoyl)propanamide IUPAC Name: (2R)-2-[[4-benzyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(methylcarbamoyl)propanamide Traditional Name: (2R)-2-[[4-benzyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]-N-(methylcarbamoyl)propionamide Formula: C20H20FN5O2S MolecularWeight: 413.468503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)SC1=NN=C(N1CC2=CC=CC=C2)C3=CC=CC=C3F

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC)SC1=NN=C(N1CC2=CC=CC=C2)C3=CC=CC=C3F

InChI

InChI=1S/C20H20FN5O2S/c1-13(18(27)23-19(28)22-2)29-20-25-24-17(15-10-6-7-11-16(15)21)26(20)12-14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H2,22,23,27,28)/t13-/m1/s1