3-(4-bromophenyl)-6-[4-(4-methylpiperazin-1-yl)butoxy]-1,2-benzothiazole

Systemtic Name: 3-(4-bromophenyl)-6-[4-(4-methylpiperazin-1-yl)butoxy]-1,2-benzothiazole Openeye Name: 3-(4-bromophenyl)-6-[4-(4-methylpiperazin-1-yl)butoxy]-1,2-benzothiazole CAS Name: 3-(4-bromophenyl)-6-[4-(4-methyl-1-piperazinyl)butoxy]-1,2-benzothiazole IUPAC Name: 3-(4-bromophenyl)-6-[4-(4-methylpiperazin-1-yl)butoxy]-1,2-benzothiazole Traditional Name: 3-(4-bromophenyl)-6-[4-(4-methylpiperazino)butoxy]-1,2-benzothiazole Formula: C22H26BrN3OS MolecularWeight: 460.43034

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCCOC2=CC3=C(C=C2)C(=NS3)C4=CC=C(C=C4)Br

Isomeric SMILES

CN1CCN(CC1)CCCCOC2=CC3=C(C=C2)C(=NS3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H26BrN3OS/c1-25-11-13-26(14-12-25)10-2-3-15-27-19-8-9-20-21(16-19)28-24-22(20)17-4-6-18(23)7-5-17/h4-9,16H,2-3,10-15H2,1H3