2-(3,5-dimethylpyrazol-1-yl)-3-(4-thiophen-2-ylsulfonylpiperazin-1-yl)quinoxaline

Systemtic Name: 2-(3,5-dimethylpyrazol-1-yl)-3-(4-thiophen-2-ylsulfonylpiperazin-1-yl)quinoxaline Openeye Name: 2-(3,5-dimethylpyrazol-1-yl)-3-[4-(2-thienylsulfonyl)piperazin-1-yl]quinoxaline CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)-3-(4-thiophen-2-ylsulfonyl-1-piperazinyl)quinoxaline IUPAC Name: 2-(3,5-dimethylpyrazol-1-yl)-3-(4-thiophen-2-ylsulfonylpiperazin-1-yl)quinoxaline Traditional Name: 2-(3,5-dimethylpyrazol-1-yl)-3-[4-(2-thienylsulfonyl)piperazino]quinoxaline Formula: C21H22N6O2S2 MolecularWeight: 454.56838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC3=CC=CC=C3N=C2N4CCN(CC4)S(=O)(=O)C5=CC=CS5)C

Isomeric SMILES

CC1=CC(=NN1C2=NC3=CC=CC=C3N=C2N4CCN(CC4)S(=O)(=O)C5=CC=CS5)C

InChI

InChI=1S/C21H22N6O2S2/c1-15-14-16(2)27(24-15)21-20(22-17-6-3-4-7-18(17)23-21)25-9-11-26(12-10-25)31(28,29)19-8-5-13-30-19/h3-8,13-14H,9-12H2,1-2H3