2-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]methyl]pyrazole-3,4-diamine dihydrochloride

Systemtic Name: 2-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]methyl]pyrazole-3,4-diamine dihydrochloride Openeye Name: 2-[[4-(4-bromophenyl)thiazol-2-yl]methyl]pyrazole-3,4-diamine dihydrochloride CAS Name: 2-[[4-(4-bromophenyl)-2-thiazolyl]methyl]pyrazole-3,4-diamine dihydrochloride IUPAC Name: 2-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]methyl]pyrazole-3,4-diamine dihydrochloride Traditional Name: [4-amino-2-[[4-(4-bromophenyl)thiazol-2-yl]methyl]pyrazol-3-yl]amine dihydrochloride Formula: C13H14BrCl2N5S MolecularWeight: 423.15876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CSC(=N2)CN3C(=C(C=N3)N)N)Br.Cl.Cl

Isomeric SMILES

C1=CC(=CC=C1C2=CSC(=N2)CN3C(=C(C=N3)N)N)Br.Cl.Cl

InChI

InChI=1S/C13H12BrN5S.2ClH/c14-9-3-1-8(2-4-9)11-7-20-12(18-11)6-19-13(16)10(15)5-17-19;;/h1-5,7H,6,15-16H2;2*1H