3-(4-bromophenyl)-4-(3,5-dimethylphenyl)-5-propylsulfanyl-1,2,4-triazole

Systemtic Name: 3-(4-bromophenyl)-4-(3,5-dimethylphenyl)-5-propylsulfanyl-1,2,4-triazole Openeye Name: 3-(4-bromophenyl)-4-(3,5-dimethylphenyl)-5-propylsulfanyl-1,2,4-triazole CAS Name: 3-(4-bromophenyl)-4-(3,5-dimethylphenyl)-5-(propylthio)-1,2,4-triazole IUPAC Name: 3-(4-bromophenyl)-4-(3,5-dimethylphenyl)-5-propylsulfanyl-1,2,4-triazole Traditional Name: 3-(4-bromophenyl)-4-(3,5-dimethylphenyl)-5-(propylthio)-1,2,4-triazole Formula: C19H20BrN3S MolecularWeight: 402.3512

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1C2=CC(=CC(=C2)C)C)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCSC1=NN=C(N1C2=CC(=CC(=C2)C)C)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H20BrN3S/c1-4-9-24-19-22-21-18(15-5-7-16(20)8-6-15)23(19)17-11-13(2)10-14(3)12-17/h5-8,10-12H,4,9H2,1-3H3