3-methyl-6-[1-oxidanyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-methyl-6-[1-oxidanyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,3-benzoxazol-2-one Openeye Name: 6-[1-hydroxy-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-3-methyl-1,3-benzoxazol-2-one CAS Name: 6-[1-hydroxy-4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-3-methyl-1,3-benzoxazol-2-one IUPAC Name: 6-[1-hydroxy-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-3-methyl-1,3-benzoxazol-2-one Traditional Name: 6-[1-hydroxy-4-[4-(2-pyrimidyl)piperazino]butyl]-3-methyl-1,3-benzoxazol-2-one Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(CCCN3CCN(CC3)C4=NC=CC=N4)O)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(CCCN3CCN(CC3)C4=NC=CC=N4)O)OC1=O

InChI

InChI=1S/C20H25N5O3/c1-23-16-6-5-15(14-18(16)28-20(23)27)17(26)4-2-9-24-10-12-25(13-11-24)19-21-7-3-8-22-19/h3,5-8,14,17,26H,2,4,9-13H2,1H3