4-(1,3-benzothiazol-2-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]butan-1-one

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]butan-1-one Openeye Name: 4-(1,3-benzothiazol-2-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]butan-1-one CAS Name: 4-(1,3-benzothiazol-2-yl)-1-[4-(4-fluorophenyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(1,3-benzothiazol-2-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]butan-1-one Traditional Name: 4-(1,3-benzothiazol-2-yl)-1-[4-(4-fluorophenyl)piperazino]butan-1-one Formula: C21H22FN3OS MolecularWeight: 383.482283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H22FN3OS/c22-16-8-10-17(11-9-16)24-12-14-25(15-13-24)21(26)7-3-6-20-23-18-4-1-2-5-19(18)27-20/h1-2,4-5,8-11H,3,6-7,12-15H2