(2R)-N-aminocarbonyl-2-[[5-[(1R)-1-(dimethylamino)ethyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: (2R)-N-aminocarbonyl-2-[[5-[(1R)-1-(dimethylamino)ethyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: (2R)-N-carbamoyl-2-[[5-[(1R)-1-(dimethylamino)ethyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-N-carbamoyl-2-[[5-[(1R)-1-(dimethylamino)ethyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2R)-N-carbamoyl-2-[[5-[(1R)-1-(dimethylamino)ethyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: (2R)-N-carbamoyl-2-[[5-[(1R)-1-(dimethylamino)ethyl]-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C16H21FN6O2S MolecularWeight: 380.440343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(N1C2=CC=C(C=C2)F)SC(C)C(=O)NC(=O)N)N(C)C

Isomeric SMILES

C[C@H](C1=NN=C(N1C2=CC=C(C=C2)F)S[C@H](C)C(=O)NC(=O)N)N(C)C

InChI

InChI=1S/C16H21FN6O2S/c1-9(22(3)4)13-20-21-16(26-10(2)14(24)19-15(18)25)23(13)12-7-5-11(17)6-8-12/h5-10H,1-4H3,(H3,18,19,24,25)/t9-,10-/m1/s1