O-(2,3-dimethylquinoxalin-6-yl) 4-pyridin-2-ylpiperazine-1-carbothioate

Systemtic Name: O-(2,3-dimethylquinoxalin-6-yl) 4-pyridin-2-ylpiperazine-1-carbothioate Openeye Name: O-(2,3-dimethylquinoxalin-6-yl) 4-(2-pyridyl)piperazine-1-carbothioate CAS Name: 4-(2-pyridinyl)-1-piperazinecarbothioic acid O-(2,3-dimethyl-6-quinoxalinyl) ester IUPAC Name: O-(2,3-dimethylquinoxalin-6-yl) 4-pyridin-2-ylpiperazine-1-carbothioate Traditional Name: 4-(2-pyridyl)piperazine-1-carbothioic acid O-(2,3-dimethylquinoxalin-6-yl) ester Formula: C20H21N5OS MolecularWeight: 379.47864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)OC(=S)N3CCN(CC3)C4=CC=CC=N4)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)OC(=S)N3CCN(CC3)C4=CC=CC=N4)N=C1C

InChI

InChI=1S/C20H21N5OS/c1-14-15(2)23-18-13-16(6-7-17(18)22-14)26-20(27)25-11-9-24(10-12-25)19-5-3-4-8-21-19/h3-8,13H,9-12H2,1-2H3