5-[bis(4-fluorophenyl)methyl]-4-piperazin-1-yl-3-propylsulfanyl-2H-1,3-benzothiazol-2-ol

Systemtic Name: 5-[bis(4-fluorophenyl)methyl]-4-piperazin-1-yl-3-propylsulfanyl-2H-1,3-benzothiazol-2-ol Openeye Name: 5-[bis(4-fluorophenyl)methyl]-4-piperazin-1-yl-3-propylsulfanyl-2H-1,3-benzothiazol-2-ol CAS Name: 5-[bis(4-fluorophenyl)methyl]-4-(1-piperazinyl)-3-(propylthio)-2H-1,3-benzothiazol-2-ol IUPAC Name: 5-[bis(4-fluorophenyl)methyl]-4-piperazin-1-yl-3-propylsulfanyl-2H-1,3-benzothiazol-2-ol Traditional Name: 5-[bis(4-fluorophenyl)methyl]-4-piperazino-3-(propylthio)-2H-1,3-benzothiazol-2-ol Formula: C27H29F2N3OS2 MolecularWeight: 513.665466

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Descriptors Computed from Structure

Canonical SMILES:

CCCSN1C(SC2=C1C(=C(C=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)N5CCNCC5)O

Isomeric SMILES

CCCSN1C(SC2=C1C(=C(C=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)N5CCNCC5)O

InChI

InChI=1S/C27H29F2N3OS2/c1-2-17-34-32-26-23(35-27(32)33)12-11-22(25(26)31-15-13-30-14-16-31)24(18-3-7-20(28)8-4-18)19-5-9-21(29)10-6-19/h3-12,24,27,30,33H,2,13-17H2,1H3