azepan-1-yl-[1-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carbonyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[[3-(4-fluorophenyl)-2-(methylthio)-4-imidazolyl]-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-[3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carbonyl]piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carbonyl]-4-piperidyl]methanone Formula: C23H29FN4O2S MolecularWeight: 444.565363

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C23H29FN4O2S/c1-31-23-25-16-20(28(23)19-8-6-18(24)7-9-19)22(30)27-14-10-17(11-15-27)21(29)26-12-4-2-3-5-13-26/h6-9,16-17H,2-5,10-15H2,1H3