[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-quinoxalin-2-yl-methanone

Systemtic Name: [4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-quinoxalin-2-yl-methanone Openeye Name: [4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-quinoxalin-2-yl-methanone CAS Name: [4-(4,5-dimethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-(2-quinoxalinyl)methanone IUPAC Name: [4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-quinoxalin-2-ylmethanone Traditional Name: [4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazino]-quinoxalin-2-yl-methanone Formula: C22H21N5OS MolecularWeight: 403.50004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)N3CCN(CC3)C(=O)C4=NC5=CC=CC=C5N=C4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)N3CCN(CC3)C(=O)C4=NC5=CC=CC=C5N=C4)C

InChI

InChI=1S/C22H21N5OS/c1-14-7-8-19-20(15(14)2)25-22(29-19)27-11-9-26(10-12-27)21(28)18-13-23-16-5-3-4-6-17(16)24-18/h3-8,13H,9-12H2,1-2H3