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

Systemtic Name: 6-fluoranyl-1,1-bis(oxidanylidene)-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-3-one Openeye Name: 6-fluoro-1,1-dioxo-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-3-one CAS Name: 6-fluoro-1,1-dioxo-2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-1,2-benzothiazol-3-one IUPAC Name: 6-fluoro-1,1-dioxo-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-3-one Traditional Name: 6-fluoro-1,1-diketo-2-[4-[4-(2-pyrimidyl)piperazino]butyl]-1,2-benzothiazol-3-one Formula: C19H22FN5O3S MolecularWeight: 419.473083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C(=O)C3=C(S2(=O)=O)C=C(C=C3)F)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CCCCN2C(=O)C3=C(S2(=O)=O)C=C(C=C3)F)C4=NC=CC=N4

InChI

InChI=1S/C19H22FN5O3S/c20-15-4-5-16-17(14-15)29(27,28)25(18(16)26)9-2-1-8-23-10-12-24(13-11-23)19-21-6-3-7-22-19/h3-7,14H,1-2,8-13H2