azepan-1-yl-[5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophen-2-yl]methanone

Systemtic Name: azepan-1-yl-[5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophen-2-yl]methanone Openeye Name: azepan-1-yl-[5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-2-thienyl]methanone CAS Name: 1-azepanyl-[5-[1-methyl-5-(trifluoromethyl)-3-pyrazolyl]-2-thiophenyl]methanone IUPAC Name: azepan-1-yl-[5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]thiophen-2-yl]methanone Traditional Name: azepan-1-yl-[5-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-2-thienyl]methanone Formula: C16H18F3N3OS MolecularWeight: 357.39383

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C2=CC=C(S2)C(=O)N3CCCCCC3)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=N1)C2=CC=C(S2)C(=O)N3CCCCCC3)C(F)(F)F

InChI

InChI=1S/C16H18F3N3OS/c1-21-14(16(17,18)19)10-11(20-21)12-6-7-13(24-12)15(23)22-8-4-2-3-5-9-22/h6-7,10H,2-5,8-9H2,1H3