4-(4-bromophenyl)-3-(4-tert-butylphenyl)-5-ethylsulfanyl-1,2,4-triazole

Systemtic Name: 4-(4-bromophenyl)-3-(4-tert-butylphenyl)-5-ethylsulfanyl-1,2,4-triazole Openeye Name: 4-(4-bromophenyl)-3-(4-tert-butylphenyl)-5-ethylsulfanyl-1,2,4-triazole CAS Name: 4-(4-bromophenyl)-3-(4-tert-butylphenyl)-5-(ethylthio)-1,2,4-triazole IUPAC Name: 4-(4-bromophenyl)-3-(4-tert-butylphenyl)-5-ethylsulfanyl-1,2,4-triazole Traditional Name: 4-(4-bromophenyl)-3-(4-tert-butylphenyl)-5-(ethylthio)-1,2,4-triazole Formula: C20H22BrN3S MolecularWeight: 416.37778

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C2=CC=C(C=C2)Br)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCSC1=NN=C(N1C2=CC=C(C=C2)Br)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C20H22BrN3S/c1-5-25-19-23-22-18(24(19)17-12-10-16(21)11-13-17)14-6-8-15(9-7-14)20(2,3)4/h6-13H,5H2,1-4H3