1-[2-[(4-ethanoylpiperazin-1-yl)methyl]-1,3-benzoxazol-4-yl]-1-(6-methylpyridin-3-yl)urea

Systemtic Name: 1-[2-[(4-ethanoylpiperazin-1-yl)methyl]-1,3-benzoxazol-4-yl]-1-(6-methylpyridin-3-yl)urea Openeye Name: 1-[2-[(4-acetylpiperazin-1-yl)methyl]-1,3-benzoxazol-4-yl]-1-(6-methyl-3-pyridyl)urea CAS Name: 1-[2-[(4-acetyl-1-piperazinyl)methyl]-1,3-benzoxazol-4-yl]-1-(6-methyl-3-pyridinyl)urea IUPAC Name: 1-[2-[(4-acetylpiperazin-1-yl)methyl]-1,3-benzoxazol-4-yl]-1-(6-methylpyridin-3-yl)urea Traditional Name: 1-[2-[(4-acetylpiperazino)methyl]-1,3-benzoxazol-4-yl]-1-(6-methyl-3-pyridyl)urea Formula: C21H24N6O3 MolecularWeight: 408.45366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)N(C2=C3C(=CC=C2)OC(=N3)CN4CCN(CC4)C(=O)C)C(=O)N

Isomeric SMILES

CC1=NC=C(C=C1)N(C2=C3C(=CC=C2)OC(=N3)CN4CCN(CC4)C(=O)C)C(=O)N

InChI

InChI=1S/C21H24N6O3/c1-14-6-7-16(12-23-14)27(21(22)29)17-4-3-5-18-20(17)24-19(30-18)13-25-8-10-26(11-9-25)15(2)28/h3-7,12H,8-11,13H2,1-2H3,(H2,22,29)