1-[4-(4-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]pentan-1-one

Systemtic Name: 1-[4-(4-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]pentan-1-one Openeye Name: 1-[4-(4-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]pentan-1-one CAS Name: 1-[4-[4-(methylthio)-1,3-benzothiazol-2-yl]-1-piperazinyl]-1-pentanone IUPAC Name: 1-[4-(4-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]pentan-1-one Traditional Name: 1-[4-[4-(methylthio)-1,3-benzothiazol-2-yl]piperazino]pentan-1-one Formula: C17H23N3OS2 MolecularWeight: 349.51402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1)C2=NC3=C(S2)C=CC=C3SC

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)C2=NC3=C(S2)C=CC=C3SC

InChI

InChI=1S/C17H23N3OS2/c1-3-4-8-15(21)19-9-11-20(12-10-19)17-18-16-13(22-2)6-5-7-14(16)23-17/h5-7H,3-4,8-12H2,1-2H3