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

Systemtic Name: 4-[5-[(3-bromophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-N,N-dimethyl-aniline Openeye Name: 4-[5-[(3-bromophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-N,N-dimethyl-aniline CAS Name: 4-[5-[(3-bromophenyl)methylthio]-4-methyl-1,2,4-triazol-3-yl]-N,N-dimethylaniline IUPAC Name: 4-[5-[(3-bromophenyl)methylsulfanyl]-4-methyl-1,2,4-triazol-3-yl]-N,N-dimethylaniline Traditional Name: [4-[5-[(3-bromobenzyl)thio]-4-methyl-1,2,4-triazol-3-yl]phenyl]-dimethyl-amine Formula: C18H19BrN4S MolecularWeight: 403.33926

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC(=CC=C2)Br)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CN1C(=NN=C1SCC2=CC(=CC=C2)Br)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C18H19BrN4S/c1-22(2)16-9-7-14(8-10-16)17-20-21-18(23(17)3)24-12-13-5-4-6-15(19)11-13/h4-11H,12H2,1-3H3