3-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]butyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[4-[4-(1,2-benzothiazol-3-yl)piperazino]butyl]-1,2,3-benzotriazin-4-one Formula: C22H24N6OS MolecularWeight: 420.53056

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3N=N2)C4=NSC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3N=N2)C4=NSC5=CC=CC=C54

InChI

InChI=1S/C22H24N6OS/c29-22-17-7-1-3-9-19(17)23-25-28(22)12-6-5-11-26-13-15-27(16-14-26)21-18-8-2-4-10-20(18)30-24-21/h1-4,7-10H,5-6,11-16H2