2-(4-chlorophenyl)-1-[5-methylsulfanyl-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]ethanamine

Systemtic Name: 2-(4-chlorophenyl)-1-[5-methylsulfanyl-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]ethanamine Openeye Name: 2-(4-chlorophenyl)-1-[5-methylsulfanyl-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazol-3-yl]ethanamine CAS Name: 2-(4-chlorophenyl)-1-[5-(methylthio)-4-(2-oxolanylmethyl)-1,2,4-triazol-3-yl]ethanamine IUPAC Name: 2-(4-chlorophenyl)-1-[5-methylsulfanyl-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]ethanamine Traditional Name: [2-(4-chlorophenyl)-1-[5-(methylthio)-4-(tetrahydrofurfuryl)-1,2,4-triazol-3-yl]ethyl]amine Formula: C16H21ClN4OS MolecularWeight: 352.88214

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1CC2CCCO2)C(CC3=CC=C(C=C3)Cl)N

Isomeric SMILES

CSC1=NN=C(N1CC2CCCO2)C(CC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C16H21ClN4OS/c1-23-16-20-19-15(21(16)10-13-3-2-8-22-13)14(18)9-11-4-6-12(17)7-5-11/h4-7,13-14H,2-3,8-10,18H2,1H3