[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methanone

Systemtic Name: [4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methanone Openeye Name: [4-[(5-bromo-2-thienyl)sulfonyl]piperazin-1-yl]-(5-chloro-1,3-dimethyl-pyrazol-4-yl)methanone CAS Name: [4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-(5-chloro-1,3-dimethyl-4-pyrazolyl)methanone IUPAC Name: [4-(5-bromothiophen-2-yl)sulfonylpiperazin-1-yl]-(5-chloro-1,3-dimethylpyrazol-4-yl)methanone Traditional Name: [4-[(5-bromo-2-thienyl)sulfonyl]piperazino]-(5-chloro-1,3-dimethyl-pyrazol-4-yl)methanone Formula: C14H16BrClN4O3S2 MolecularWeight: 467.78884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Br)Cl)C

InChI

InChI=1S/C14H16BrClN4O3S2/c1-9-12(13(16)18(2)17-9)14(21)19-5-7-20(8-6-19)25(22,23)11-4-3-10(15)24-11/h3-4H,5-8H2,1-2H3