5-[5-(aminomethyl)nonan-5-yl]-4-(4-bromophenyl)-1,3-thiazol-2-amine dihydrochloride

Systemtic Name: 5-[5-(aminomethyl)nonan-5-yl]-4-(4-bromophenyl)-1,3-thiazol-2-amine dihydrochloride Openeye Name: 5-[1-(aminomethyl)-1-butyl-pentyl]-4-(4-bromophenyl)thiazol-2-amine dihydrochloride CAS Name: 5-[5-(aminomethyl)nonan-5-yl]-4-(4-bromophenyl)-2-thiazolamine dihydrochloride IUPAC Name: 5-[5-(aminomethyl)nonan-5-yl]-4-(4-bromophenyl)-1,3-thiazol-2-amine dihydrochloride Traditional Name: [2-[2-amino-4-(4-bromophenyl)thiazol-5-yl]-2-butyl-hexyl]amine dihydrochloride Formula: C19H30BrCl2N3S MolecularWeight: 483.3366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)(CN)C1=C(N=C(S1)N)C2=CC=C(C=C2)Br.Cl.Cl

Isomeric SMILES

CCCCC(CCCC)(CN)C1=C(N=C(S1)N)C2=CC=C(C=C2)Br.Cl.Cl

InChI

InChI=1S/C19H28BrN3S.2ClH/c1-3-5-11-19(13-21,12-6-4-2)17-16(23-18(22)24-17)14-7-9-15(20)10-8-14;;/h7-10H,3-6,11-13,21H2,1-2H3,(H2,22,23);2*1H