N-[[3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]-1-thiophen-2-yl-ethanamine

Systemtic Name: N-[[3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]-1-thiophen-2-yl-ethanamine Openeye Name: N-[[3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]-1-(2-thienyl)ethanamine CAS Name: N-[[3-(2-fluoro-4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl]-1-thiophen-2-ylethanamine IUPAC Name: N-[[3-(2-fluoro-4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl]-1-thiophen-2-ylethanamine Traditional Name: [3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl-[1-(2-thienyl)ethyl]amine Formula: C23H22FN3OS MolecularWeight: 407.503683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NCC2=CN(N=C2C3=C(C=C(C=C3)OC)F)C4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=CS1)NCC2=CN(N=C2C3=C(C=C(C=C3)OC)F)C4=CC=CC=C4

InChI

InChI=1S/C23H22FN3OS/c1-16(22-9-6-12-29-22)25-14-17-15-27(18-7-4-3-5-8-18)26-23(17)20-11-10-19(28-2)13-21(20)24/h3-13,15-16,25H,14H2,1-2H3