4-(4-bromophenyl)-N-(3-methylphenyl)-3-(4-methylpiperazin-1-yl)-1,3-thiazol-2-imine bromide

Systemtic Name: 4-(4-bromophenyl)-N-(3-methylphenyl)-3-(4-methylpiperazin-1-yl)-1,3-thiazol-2-imine bromide Openeye Name: 4-(4-bromophenyl)-3-(4-methylpiperazin-1-yl)-N-(m-tolyl)thiazol-2-imine bromide CAS Name: 4-(4-bromophenyl)-N-(3-methylphenyl)-3-(4-methyl-1-piperazinyl)-2-thiazolimine bromide IUPAC Name: 4-(4-bromophenyl)-N-(3-methylphenyl)-3-(4-methylpiperazin-1-yl)-1,3-thiazol-2-imine bromide Traditional Name: [4-(4-bromophenyl)-3-(4-methylpiperazino)-4-thiazolin-2-ylidene]-(m-tolyl)amine bromide Formula: C21H23Br2N4S- MolecularWeight: 523.30712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N=C2N(C(=CS2)C3=CC=C(C=C3)Br)N4CCN(CC4)C.[Br-]

Isomeric SMILES

CC1=CC(=CC=C1)N=C2N(C(=CS2)C3=CC=C(C=C3)Br)N4CCN(CC4)C.[Br-]

InChI

InChI=1S/C21H23BrN4S.BrH/c1-16-4-3-5-19(14-16)23-21-26(25-12-10-24(2)11-13-25)20(15-27-21)17-6-8-18(22)9-7-17;/h3-9,14-15H,10-13H2,1-2H3;1H/p-1