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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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