1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3-(4-methyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)piperidine

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3-(4-methyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)piperidine Openeye Name: 3-(5-allylsulfanyl-4-methyl-1,2,4-triazol-3-yl)-1-[(2-chloro-6-fluoro-phenyl)methyl]piperidine CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-3-[4-methyl-5-(prop-2-enylthio)-1,2,4-triazol-3-yl]piperidine IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]-3-(4-methyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)piperidine Traditional Name: 3-[5-(allylthio)-4-methyl-1,2,4-triazol-3-yl]-1-(2-chloro-6-fluoro-benzyl)piperidine Formula: C18H22ClFN4S MolecularWeight: 380.910483

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC=C)C2CCCN(C2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CN1C(=NN=C1SCC=C)C2CCCN(C2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C18H22ClFN4S/c1-3-10-25-18-22-21-17(23(18)2)13-6-5-9-24(11-13)12-14-15(19)7-4-8-16(14)20/h3-4,7-8,13H,1,5-6,9-12H2,2H3