2-(3,5-dimethylpyrazol-1-yl)-1-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3,5-dimethylpyrazol-1-yl)-1-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Openeye Name: 2-(3,5-dimethylpyrazol-1-yl)-1-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)-1-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-piperazinyl]ethanone IUPAC Name: 2-(3,5-dimethylpyrazol-1-yl)-1-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Traditional Name: 2-(3,5-dimethylpyrazol-1-yl)-1-[4-(6-mesyl-1,3-benzothiazol-2-yl)piperazino]ethanone Formula: C19H23N5O3S2 MolecularWeight: 433.54762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=NN1CC(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C)C

InChI

InChI=1S/C19H23N5O3S2/c1-13-10-14(2)24(21-13)12-18(25)22-6-8-23(9-7-22)19-20-16-5-4-15(29(3,26)27)11-17(16)28-19/h4-5,10-11H,6-9,12H2,1-3H3