[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2,3-dimethylquinoxalin-6-yl)methanone

Systemtic Name: [3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2,3-dimethylquinoxalin-6-yl)methanone Openeye Name: [3-(1,3-benzothiazol-2-yl)-1-piperidyl]-(2,3-dimethylquinoxalin-6-yl)methanone CAS Name: [3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-(2,3-dimethyl-6-quinoxalinyl)methanone IUPAC Name: [3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-(2,3-dimethylquinoxalin-6-yl)methanone Traditional Name: [3-(1,3-benzothiazol-2-yl)piperidino]-(2,3-dimethylquinoxalin-6-yl)methanone Formula: C23H22N4OS MolecularWeight: 402.51198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)N3CCCC(C3)C4=NC5=CC=CC=C5S4)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)N3CCCC(C3)C4=NC5=CC=CC=C5S4)N=C1C

InChI

InChI=1S/C23H22N4OS/c1-14-15(2)25-20-12-16(9-10-18(20)24-14)23(28)27-11-5-6-17(13-27)22-26-19-7-3-4-8-21(19)29-22/h3-4,7-10,12,17H,5-6,11,13H2,1-2H3