4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-bromanyl-aniline

Systemtic Name: 4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-bromanyl-aniline Openeye Name: 4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-bromo-aniline CAS Name: 4-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]-2-bromoaniline IUPAC Name: 4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-bromoaniline Traditional Name: [4-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]-2-bromo-phenyl]amine Formula: C19H21BrN4S MolecularWeight: 417.36584

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC(=C(C=C2)N)Br)C3=NSC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1CCC2=CC(=C(C=C2)N)Br)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C19H21BrN4S/c20-16-13-14(5-6-17(16)21)7-8-23-9-11-24(12-10-23)19-15-3-1-2-4-18(15)25-22-19/h1-6,13H,7-12,21H2