2-[4-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carbonyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[[3-(4-fluorophenyl)-2-(methylthio)-4-imidazolyl]-oxomethyl]-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carbonyl]piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carbonyl]piperazino]-1-pyrrolidino-ethanone Formula: C21H26FN5O2S MolecularWeight: 431.526843

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)N3CCN(CC3)CC(=O)N4CCCC4

Isomeric SMILES

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)N3CCN(CC3)CC(=O)N4CCCC4

InChI

InChI=1S/C21H26FN5O2S/c1-30-21-23-14-18(27(21)17-6-4-16(22)5-7-17)20(29)26-12-10-24(11-13-26)15-19(28)25-8-2-3-9-25/h4-7,14H,2-3,8-13,15H2,1H3