1,1-bis(oxidanylidene)-2-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-3-one

Systemtic Name: 1,1-bis(oxidanylidene)-2-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-3-one Openeye Name: 1,1-dioxo-2-[4-[4-(2-pyridyl)piperazin-1-yl]butyl]-1,2-benzothiazol-3-one CAS Name: 1,1-dioxo-2-[4-[4-(2-pyridinyl)-1-piperazinyl]butyl]-1,2-benzothiazol-3-one IUPAC Name: 1,1-dioxo-2-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-2-[4-[4-(2-pyridyl)piperazino]butyl]-1,2-benzothiazol-3-one Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3S2(=O)=O)C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3S2(=O)=O)C4=CC=CC=N4

InChI

InChI=1S/C20H24N4O3S/c25-20-17-7-1-2-8-18(17)28(26,27)24(20)12-6-5-11-22-13-15-23(16-14-22)19-9-3-4-10-21-19/h1-4,7-10H,5-6,11-16H2