(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(5-chloro-1,3-dimethyl-pyrazol-4-yl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-(5-chloro-1,3-dimethyl-4-pyrazolyl)methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(5-chloro-1,3-dimethylpyrazol-4-yl)methanone Traditional Name: (4-besylpiperazino)-(5-chloro-1,3-dimethyl-pyrazol-4-yl)methanone Formula: C16H19ClN4O3S MolecularWeight: 382.86506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)Cl)C

InChI

InChI=1S/C16H19ClN4O3S/c1-12-14(15(17)19(2)18-12)16(22)20-8-10-21(11-9-20)25(23,24)13-6-4-3-5-7-13/h3-7H,8-11H2,1-2H3