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

Systemtic Name: 4-[5-[(3-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]aniline Openeye Name: 4-[5-[(3-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]aniline CAS Name: 4-[5-[(3-bromophenyl)methylthio]-4-ethyl-1,2,4-triazol-3-yl]aniline IUPAC Name: 4-[5-[(3-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]aniline Traditional Name: [4-[5-[(3-bromobenzyl)thio]-4-ethyl-1,2,4-triazol-3-yl]phenyl]amine Formula: C17H17BrN4S MolecularWeight: 389.31268

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC(=CC=C2)Br)C3=CC=C(C=C3)N

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC(=CC=C2)Br)C3=CC=C(C=C3)N

InChI

InChI=1S/C17H17BrN4S/c1-2-22-16(13-6-8-15(19)9-7-13)20-21-17(22)23-11-12-4-3-5-14(18)10-12/h3-10H,2,11,19H2,1H3