4-(4-bromophenyl)-5-[2-(dioctylamino)ethyl]-1,3-thiazol-2-amine dihydrochloride

Systemtic Name: 4-(4-bromophenyl)-5-[2-(dioctylamino)ethyl]-1,3-thiazol-2-amine dihydrochloride Openeye Name: 4-(4-bromophenyl)-5-[2-(dioctylamino)ethyl]thiazol-2-amine dihydrochloride CAS Name: 4-(4-bromophenyl)-5-[2-(dioctylamino)ethyl]-2-thiazolamine dihydrochloride IUPAC Name: 4-(4-bromophenyl)-5-[2-(dioctylamino)ethyl]-1,3-thiazol-2-amine dihydrochloride Traditional Name: 2-[2-amino-4-(4-bromophenyl)thiazol-5-yl]ethyl-dioctyl-amine dihydrochloride Formula: C27H46BrCl2N3S MolecularWeight: 595.54924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(CCCCCCCC)CCC1=C(N=C(S1)N)C2=CC=C(C=C2)Br.Cl.Cl

Isomeric SMILES

CCCCCCCCN(CCCCCCCC)CCC1=C(N=C(S1)N)C2=CC=C(C=C2)Br.Cl.Cl

InChI

InChI=1S/C27H44BrN3S.2ClH/c1-3-5-7-9-11-13-20-31(21-14-12-10-8-6-4-2)22-19-25-26(30-27(29)32-25)23-15-17-24(28)18-16-23;;/h15-18H,3-14,19-22H2,1-2H3,(H2,29,30);2*1H