1-(3-fluorophenyl)sulfonyl-4-[4-methyl-5-(2-pyrrolidin-1-ylethylsulfanyl)-1,2,4-triazol-3-yl]piperidine

Systemtic Name: 1-(3-fluorophenyl)sulfonyl-4-[4-methyl-5-(2-pyrrolidin-1-ylethylsulfanyl)-1,2,4-triazol-3-yl]piperidine Openeye Name: 1-(3-fluorophenyl)sulfonyl-4-[4-methyl-5-(2-pyrrolidin-1-ylethylsulfanyl)-1,2,4-triazol-3-yl]piperidine CAS Name: 1-(3-fluorophenyl)sulfonyl-4-[4-methyl-5-[2-(1-pyrrolidinyl)ethylthio]-1,2,4-triazol-3-yl]piperidine IUPAC Name: 1-(3-fluorophenyl)sulfonyl-4-[4-methyl-5-(2-pyrrolidin-1-ylethylsulfanyl)-1,2,4-triazol-3-yl]piperidine Traditional Name: 1-(3-fluorophenyl)sulfonyl-4-[4-methyl-5-(2-pyrrolidinoethylthio)-1,2,4-triazol-3-yl]piperidine Formula: C20H28FN5O2S2 MolecularWeight: 453.597023

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCN2CCCC2)C3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

CN1C(=NN=C1SCCN2CCCC2)C3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C20H28FN5O2S2/c1-24-19(22-23-20(24)29-14-13-25-9-2-3-10-25)16-7-11-26(12-8-16)30(27,28)18-6-4-5-17(21)15-18/h4-6,15-16H,2-3,7-14H2,1H3