3-[4-[2-(3-nitrophenyl)ethyl]piperazin-1-yl]-1,2-benzothiazole

Systemtic Name: 3-[4-[2-(3-nitrophenyl)ethyl]piperazin-1-yl]-1,2-benzothiazole Openeye Name: 3-[4-[2-(3-nitrophenyl)ethyl]piperazin-1-yl]-1,2-benzothiazole CAS Name: 3-[4-[2-(3-nitrophenyl)ethyl]-1-piperazinyl]-1,2-benzothiazole IUPAC Name: 3-[4-[2-(3-nitrophenyl)ethyl]piperazin-1-yl]-1,2-benzothiazole Traditional Name: 3-[4-[2-(3-nitrophenyl)ethyl]piperazino]-1,2-benzothiazole Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC(=CC=C2)[N+](=O)[O-])C3=NSC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1CCC2=CC(=CC=C2)[N+](=O)[O-])C3=NSC4=CC=CC=C43

InChI

InChI=1S/C19H20N4O2S/c24-23(25)16-5-3-4-15(14-16)8-9-21-10-12-22(13-11-21)19-17-6-1-2-7-18(17)26-20-19/h1-7,14H,8-13H2