[4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-(1-methylpyrazol-4-yl)methanone

Systemtic Name: [4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-(1-methylpyrazol-4-yl)methanone Openeye Name: [4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-(1-methylpyrazol-4-yl)methanone CAS Name: [4-(4-cyclohexylphenyl)sulfonyl-1-piperazinyl]-(1-methyl-4-pyrazolyl)methanone IUPAC Name: [4-(4-cyclohexylphenyl)sulfonylpiperazin-1-yl]-(1-methylpyrazol-4-yl)methanone Traditional Name: [4-(4-cyclohexylphenyl)sulfonylpiperazino]-(1-methylpyrazol-4-yl)methanone Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C4CCCCC4

Isomeric SMILES

CN1C=C(C=N1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C4CCCCC4

InChI

InChI=1S/C21H28N4O3S/c1-23-16-19(15-22-23)21(26)24-11-13-25(14-12-24)29(27,28)20-9-7-18(8-10-20)17-5-3-2-4-6-17/h7-10,15-17H,2-6,11-14H2,1H3