3-[4-[2-(5-bromanylthiophen-2-yl)sulfanylethyl]piperazin-1-yl]-1,2-benzothiazole

Systemtic Name: 3-[4-[2-(5-bromanylthiophen-2-yl)sulfanylethyl]piperazin-1-yl]-1,2-benzothiazole Openeye Name: 3-[4-[2-[(5-bromo-2-thienyl)sulfanyl]ethyl]piperazin-1-yl]-1,2-benzothiazole CAS Name: 3-[4-[2-[(5-bromo-2-thiophenyl)thio]ethyl]-1-piperazinyl]-1,2-benzothiazole IUPAC Name: 3-[4-[2-(5-bromothiophen-2-yl)sulfanylethyl]piperazin-1-yl]-1,2-benzothiazole Traditional Name: 3-[4-[2-[(5-bromo-2-thienyl)thio]ethyl]piperazino]-1,2-benzothiazole Formula: C17H18BrN3S3 MolecularWeight: 440.44392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCSC2=CC=C(S2)Br)C3=NSC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1CCSC2=CC=C(S2)Br)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C17H18BrN3S3/c18-15-5-6-16(23-15)22-12-11-20-7-9-21(10-8-20)17-13-3-1-2-4-14(13)24-19-17/h1-6H,7-12H2