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

Systemtic Name: 2,4-dimethyl-N-[(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]aniline Openeye Name: 2,4-dimethyl-N-[(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]aniline CAS Name: 2,4-dimethyl-N-[[5-(methylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]aniline IUPAC Name: 2,4-dimethyl-N-[(5-methylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]aniline Traditional Name: (2,4-dimethylphenyl)-[[5-(methylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]amine Formula: C18H20N4S MolecularWeight: 324.4432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N4S/c1-13-9-10-16(14(2)11-13)19-12-17-20-21-18(23-3)22(17)15-7-5-4-6-8-15/h4-11,19H,12H2,1-3H3