6-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-3H-1,3-benzothiazol-2-one

Systemtic Name: 6-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-3H-1,3-benzothiazol-2-one Openeye Name: 6-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-3H-1,3-benzothiazol-2-one CAS Name: 6-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]-3H-1,3-benzothiazol-2-one IUPAC Name: 6-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-3H-1,3-benzothiazol-2-one Traditional Name: 6-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]-3H-1,3-benzothiazol-2-one Formula: C20H20N4OS2 MolecularWeight: 396.529

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC3=C(C=C2)NC(=O)S3)C4=NSC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CCC2=CC3=C(C=C2)NC(=O)S3)C4=NSC5=CC=CC=C54

InChI

InChI=1S/C20H20N4OS2/c25-20-21-16-6-5-14(13-18(16)26-20)7-8-23-9-11-24(12-10-23)19-15-3-1-2-4-17(15)27-22-19/h1-6,13H,7-12H2,(H,21,25)