2-methyl-1-[4-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[4-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[4-[6-(methylthio)-1,3-benzothiazol-2-yl]-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[4-(6-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[4-[6-(methylthio)-1,3-benzothiazol-2-yl]piperazino]propan-1-one Formula: C16H21N3OS2 MolecularWeight: 335.48744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)SC

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)SC

InChI

InChI=1S/C16H21N3OS2/c1-11(2)15(20)18-6-8-19(9-7-18)16-17-13-5-4-12(21-3)10-14(13)22-16/h4-5,10-11H,6-9H2,1-3H3