N-[(2S)-1-azanyl-3-(3-fluorophenyl)propan-2-yl]-2-(2-methylpyrazol-3-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-[(2S)-1-azanyl-3-(3-fluorophenyl)propan-2-yl]-2-(2-methylpyrazol-3-yl)-1,3-thiazole-4-carboxamide Openeye Name: N-[(1S)-1-(aminomethyl)-2-(3-fluorophenyl)ethyl]-2-(2-methylpyrazol-3-yl)thiazole-4-carboxamide CAS Name: N-[(2S)-1-amino-3-(3-fluorophenyl)propan-2-yl]-2-(2-methyl-3-pyrazolyl)-4-thiazolecarboxamide IUPAC Name: N-[(2S)-1-amino-3-(3-fluorophenyl)propan-2-yl]-2-(2-methylpyrazol-3-yl)-1,3-thiazole-4-carboxamide Traditional Name: N-[(1S)-1-(aminomethyl)-2-(3-fluorophenyl)ethyl]-2-(2-methylpyrazol-3-yl)thiazole-4-carboxamide Formula: C17H18FN5OS MolecularWeight: 359.421123

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C2=NC(=CS2)C(=O)NC(CC3=CC(=CC=C3)F)CN

Isomeric SMILES

CN1C(=CC=N1)C2=NC(=CS2)C(=O)N[C@@H](CC3=CC(=CC=C3)F)CN

InChI

InChI=1S/C17H18FN5OS/c1-23-15(5-6-20-23)17-22-14(10-25-17)16(24)21-13(9-19)8-11-3-2-4-12(18)7-11/h2-7,10,13H,8-9,19H2,1H3,(H,21,24)/t13-/m0/s1