[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(6-fluoranyl-1-benzothiophen-2-yl)methanone

Systemtic Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(6-fluoranyl-1-benzothiophen-2-yl)methanone Openeye Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(6-fluorobenzothiophen-2-yl)methanone CAS Name: [4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-(6-fluoro-1-benzothiophen-2-yl)methanone IUPAC Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(6-fluoro-1-benzothiophen-2-yl)methanone Traditional Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazino]-(6-fluorobenzothiophen-2-yl)methanone Formula: C21H18FN3OS2 MolecularWeight: 411.515523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3S2)C(=O)C4=CC5=C(S4)C=C(C=C5)F

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3S2)C(=O)C4=CC5=C(S4)C=C(C=C5)F

InChI

InChI=1S/C21H18FN3OS2/c22-15-6-5-14-11-19(27-18(14)12-15)21(26)25-9-7-24(8-10-25)13-20-23-16-3-1-2-4-17(16)28-20/h1-6,11-12H,7-10,13H2