6-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one Openeye Name: 6-[[3-(1,3-benzothiazol-2-yl)-1-piperidyl]sulfonyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[[3-(1,3-benzothiazol-2-yl)-1-piperidinyl]sulfonyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-(1,3-benzothiazol-2-yl)piperidino]sulfonyl-4H-1,4-benzoxazin-3-one Formula: C20H19N3O4S2 MolecularWeight: 429.51256

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C20H19N3O4S2/c24-19-12-27-17-8-7-14(10-16(17)21-19)29(25,26)23-9-3-4-13(11-23)20-22-15-5-1-2-6-18(15)28-20/h1-2,5-8,10,13H,3-4,9,11-12H2,(H,21,24)