N-[[5-[(2-chlorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methyl]-1-cyclohexyl-N-methyl-methanamine

Systemtic Name: N-[[5-[(2-chlorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methyl]-1-cyclohexyl-N-methyl-methanamine Openeye Name: N-[[5-[(2-chlorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methyl]-1-cyclohexyl-N-methyl-methanamine CAS Name: N-[[5-[(2-chlorophenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]methyl]-1-cyclohexyl-N-methylmethanamine IUPAC Name: N-[[5-[(2-chlorophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]methyl]-1-cyclohexyl-N-methylmethanamine Traditional Name: [5-[(2-chlorobenzyl)thio]-4-methyl-1,2,4-triazol-3-yl]methyl-(cyclohexylmethyl)-methyl-amine Formula: C19H27ClN4S MolecularWeight: 378.96248

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2Cl)CN(C)CC3CCCCC3

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2Cl)CN(C)CC3CCCCC3

InChI

InChI=1S/C19H27ClN4S/c1-23(12-15-8-4-3-5-9-15)13-18-21-22-19(24(18)2)25-14-16-10-6-7-11-17(16)20/h6-7,10-11,15H,3-5,8-9,12-14H2,1-2H3