2-[[4-(3-fluorophenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone

Systemtic Name: 2-[[4-(3-fluorophenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone Openeye Name: 2-[[4-(3-fluorophenyl)-5-morpholino-1,2,4-triazol-3-yl]sulfanyl]-1-[(2S)-2-methyl-1-piperidyl]ethanone CAS Name: 2-[[4-(3-fluorophenyl)-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]-1-[(2S)-2-methyl-1-piperidinyl]ethanone IUPAC Name: 2-[[4-(3-fluorophenyl)-5-morpholin-4-yl-1,2,4-triazol-3-yl]sulfanyl]-1-[(2S)-2-methylpiperidin-1-yl]ethanone Traditional Name: 2-[[4-(3-fluorophenyl)-5-morpholino-1,2,4-triazol-3-yl]thio]-1-[(2S)-2-methylpiperidino]ethanone Formula: C20H26FN5O2S MolecularWeight: 419.516143

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CSC2=NN=C(N2C3=CC(=CC=C3)F)N4CCOCC4

Isomeric SMILES

C[C@H]1CCCCN1C(=O)CSC2=NN=C(N2C3=CC(=CC=C3)F)N4CCOCC4

InChI

InChI=1S/C20H26FN5O2S/c1-15-5-2-3-8-25(15)18(27)14-29-20-23-22-19(24-9-11-28-12-10-24)26(20)17-7-4-6-16(21)13-17/h4,6-7,13,15H,2-3,5,8-12,14H2,1H3/t15-/m0/s1