2-azanyl-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3-fluoranyl-benzamide

Systemtic Name: 2-azanyl-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3-fluoranyl-benzamide Openeye Name: 2-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3-fluoro-benzamide CAS Name: 2-amino-N-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]butyl]-3-fluorobenzamide IUPAC Name: 2-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3-fluorobenzamide Traditional Name: 2-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazino]butyl]-3-fluoro-benzamide Formula: C22H26FN5OS MolecularWeight: 427.538143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCNC(=O)C2=C(C(=CC=C2)F)N)C3=NSC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1CCCCNC(=O)C2=C(C(=CC=C2)F)N)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C22H26FN5OS/c23-18-8-5-7-17(20(18)24)22(29)25-10-3-4-11-27-12-14-28(15-13-27)21-16-6-1-2-9-19(16)30-26-21/h1-2,5-9H,3-4,10-15,24H2,(H,25,29)