3-(4-bromanyl-3-methyl-pyrazol-1-yl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(4-bromanyl-3-methyl-pyrazol-1-yl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propan-1-one Openeye Name: 3-(4-bromo-3-methyl-pyrazol-1-yl)-1-[4-(2-thienylsulfonyl)piperazin-1-yl]propan-1-one CAS Name: 3-(4-bromo-3-methyl-1-pyrazolyl)-1-(4-thiophen-2-ylsulfonyl-1-piperazinyl)-1-propanone IUPAC Name: 3-(4-bromo-3-methylpyrazol-1-yl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propan-1-one Traditional Name: 3-(4-bromo-3-methyl-pyrazol-1-yl)-1-[4-(2-thienylsulfonyl)piperazino]propan-1-one Formula: C15H19BrN4O3S2 MolecularWeight: 447.37036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1Br)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=NN(C=C1Br)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C15H19BrN4O3S2/c1-12-13(16)11-19(17-12)5-4-14(21)18-6-8-20(9-7-18)25(22,23)15-3-2-10-24-15/h2-3,10-11H,4-9H2,1H3