6-(1,3-benzothiazol-2-ylamino)-1-[4-(4-fluorophenyl)piperazin-1-yl]hexan-1-one

Systemtic Name: 6-(1,3-benzothiazol-2-ylamino)-1-[4-(4-fluorophenyl)piperazin-1-yl]hexan-1-one Openeye Name: 6-(1,3-benzothiazol-2-ylamino)-1-[4-(4-fluorophenyl)piperazin-1-yl]hexan-1-one CAS Name: 6-(1,3-benzothiazol-2-ylamino)-1-[4-(4-fluorophenyl)-1-piperazinyl]-1-hexanone IUPAC Name: 6-(1,3-benzothiazol-2-ylamino)-1-[4-(4-fluorophenyl)piperazin-1-yl]hexan-1-one Traditional Name: 6-(1,3-benzothiazol-2-ylamino)-1-[4-(4-fluorophenyl)piperazino]hexan-1-one Formula: C23H27FN4OS MolecularWeight: 426.550083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCCCCNC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCCCCNC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H27FN4OS/c24-18-9-11-19(12-10-18)27-14-16-28(17-15-27)22(29)8-2-1-5-13-25-23-26-20-6-3-4-7-21(20)30-23/h3-4,6-7,9-12H,1-2,5,8,13-17H2,(H,25,26)