2-(4-chloranylpyrazol-1-yl)-1-[4-(1,5-dimethylpyrazol-4-yl)sulfonylpiperazin-1-yl]butan-1-one

Systemtic Name: 2-(4-chloranylpyrazol-1-yl)-1-[4-(1,5-dimethylpyrazol-4-yl)sulfonylpiperazin-1-yl]butan-1-one Openeye Name: 2-(4-chloropyrazol-1-yl)-1-[4-(1,5-dimethylpyrazol-4-yl)sulfonylpiperazin-1-yl]butan-1-one CAS Name: 2-(4-chloro-1-pyrazolyl)-1-[4-[(1,5-dimethyl-4-pyrazolyl)sulfonyl]-1-piperazinyl]-1-butanone IUPAC Name: 2-(4-chloropyrazol-1-yl)-1-[4-(1,5-dimethylpyrazol-4-yl)sulfonylpiperazin-1-yl]butan-1-one Traditional Name: 2-(4-chloropyrazol-1-yl)-1-[4-(1,5-dimethylpyrazol-4-yl)sulfonylpiperazino]butan-1-one Formula: C16H23ClN6O3S MolecularWeight: 414.91022

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCN(CC1)S(=O)(=O)C2=C(N(N=C2)C)C)N3C=C(C=N3)Cl

Isomeric SMILES

CCC(C(=O)N1CCN(CC1)S(=O)(=O)C2=C(N(N=C2)C)C)N3C=C(C=N3)Cl

InChI

InChI=1S/C16H23ClN6O3S/c1-4-14(23-11-13(17)9-19-23)16(24)21-5-7-22(8-6-21)27(25,26)15-10-18-20(3)12(15)2/h9-11,14H,4-8H2,1-3H3