3-[4-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-4-oxidanylidene-butyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[4-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-4-oxidanylidene-butyl]-1,3-benzoxazol-2-one Openeye Name: 3-[4-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-4-oxo-butyl]-1,3-benzoxazol-2-one CAS Name: 3-[4-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-4-oxobutyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[4-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-4-oxobutyl]-1,3-benzoxazol-2-one Traditional Name: 3-[4-[4-(5-bromo-2-pyridyl)piperazino]-4-keto-butyl]-1,3-benzoxazol-2-one Formula: C20H21BrN4O3 MolecularWeight: 445.30974

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)Br)C(=O)CCCN3C4=CC=CC=C4OC3=O

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)Br)C(=O)CCCN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C20H21BrN4O3/c21-15-7-8-18(22-14-15)23-10-12-24(13-11-23)19(26)6-3-9-25-16-4-1-2-5-17(16)28-20(25)27/h1-2,4-5,7-8,14H,3,6,9-13H2