3-[[2-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-6-chloranyl-1,3-benzoxazol-2-one

Systemtic Name: 3-[[2-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-6-chloranyl-1,3-benzoxazol-2-one Openeye Name: 3-[[2-(1,3-benzothiazol-2-yl)-1-piperidyl]methyl]-6-chloro-1,3-benzoxazol-2-one CAS Name: 3-[[2-(1,3-benzothiazol-2-yl)-1-piperidinyl]methyl]-6-chloro-1,3-benzoxazol-2-one IUPAC Name: 3-[[2-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-6-chloro-1,3-benzoxazol-2-one Traditional Name: 3-[[2-(1,3-benzothiazol-2-yl)piperidino]methyl]-6-chloro-1,3-benzoxazol-2-one Formula: C20H18ClN3O2S MolecularWeight: 399.89382

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=NC3=CC=CC=C3S2)CN4C5=C(C=C(C=C5)Cl)OC4=O

Isomeric SMILES

C1CCN(C(C1)C2=NC3=CC=CC=C3S2)CN4C5=C(C=C(C=C5)Cl)OC4=O

InChI

InChI=1S/C20H18ClN3O2S/c21-13-8-9-15-17(11-13)26-20(25)24(15)12-23-10-4-3-6-16(23)19-22-14-5-1-2-7-18(14)27-19/h1-2,5,7-9,11,16H,3-4,6,10,12H2