N-[[5-(3-fluoranyl-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]-2-(1,3-thiazol-4-yl)ethanamine

Systemtic Name: N-[[5-(3-fluoranyl-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]-2-(1,3-thiazol-4-yl)ethanamine Openeye Name: N-[[5-(3-fluoro-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl]-2-thiazol-4-yl-ethanamine CAS Name: N-[[5-(3-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-2-(4-thiazolyl)ethanamine IUPAC Name: N-[[5-(3-fluoro-4-methoxyphenyl)-1H-pyrazol-4-yl]methyl]-2-(1,3-thiazol-4-yl)ethanamine Traditional Name: [5-(3-fluoro-4-methoxy-phenyl)-1H-pyrazol-4-yl]methyl-(2-thiazol-4-ylethyl)amine Formula: C16H17FN4OS MolecularWeight: 332.395783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C=NN2)CNCCC3=CSC=N3)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C=NN2)CNCCC3=CSC=N3)F

InChI

InChI=1S/C16H17FN4OS/c1-22-15-3-2-11(6-14(15)17)16-12(8-20-21-16)7-18-5-4-13-9-23-10-19-13/h2-3,6,8-10,18H,4-5,7H2,1H3,(H,20,21)