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

Systemtic Name: N-[[4-(3-chlorophenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-4-methyl-aniline Openeye Name: N-[[4-(3-chlorophenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-4-methyl-aniline CAS Name: N-[[4-(3-chlorophenyl)-5-(methylthio)-1,2,4-triazol-3-yl]methyl]-4-methylaniline IUPAC Name: N-[[4-(3-chlorophenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-4-methylaniline Traditional Name: [4-(3-chlorophenyl)-5-(methylthio)-1,2,4-triazol-3-yl]methyl-(p-tolyl)amine Formula: C17H17ClN4S MolecularWeight: 344.86168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCC2=NN=C(N2C3=CC(=CC=C3)Cl)SC

Isomeric SMILES

CC1=CC=C(C=C1)NCC2=NN=C(N2C3=CC(=CC=C3)Cl)SC

InChI

InChI=1S/C17H17ClN4S/c1-12-6-8-14(9-7-12)19-11-16-20-21-17(23-2)22(16)15-5-3-4-13(18)10-15/h3-10,19H,11H2,1-2H3