N-[(2S)-1-azanyl-3-(3-fluorophenyl)propan-2-yl]-5-(2-methylpyrazol-3-yl)-1,3-thiazole-2-carboxamide

Systemtic Name: N-[(2S)-1-azanyl-3-(3-fluorophenyl)propan-2-yl]-5-(2-methylpyrazol-3-yl)-1,3-thiazole-2-carboxamide Openeye Name: N-[(1S)-1-(aminomethyl)-2-(3-fluorophenyl)ethyl]-5-(2-methylpyrazol-3-yl)thiazole-2-carboxamide CAS Name: N-[(2S)-1-amino-3-(3-fluorophenyl)propan-2-yl]-5-(2-methyl-3-pyrazolyl)-2-thiazolecarboxamide IUPAC Name: N-[(2S)-1-amino-3-(3-fluorophenyl)propan-2-yl]-5-(2-methylpyrazol-3-yl)-1,3-thiazole-2-carboxamide Traditional Name: N-[(1S)-1-(aminomethyl)-2-(3-fluorophenyl)ethyl]-5-(2-methylpyrazol-3-yl)thiazole-2-carboxamide Formula: C17H18FN5OS MolecularWeight: 359.421123

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C2=CN=C(S2)C(=O)NC(CC3=CC(=CC=C3)F)CN

Isomeric SMILES

CN1C(=CC=N1)C2=CN=C(S2)C(=O)N[C@@H](CC3=CC(=CC=C3)F)CN

InChI

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