(3-phenyl-2,1-benzoxazol-5-yl)-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]methanone

Systemtic Name: (3-phenyl-2,1-benzoxazol-5-yl)-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]methanone Openeye Name: (3-phenyl-2,1-benzoxazol-5-yl)-[4-[2-(4-pyridyl)ethyl]piperazin-1-yl]methanone CAS Name: (3-phenyl-2,1-benzoxazol-5-yl)-[4-(2-pyridin-4-ylethyl)-1-piperazinyl]methanone IUPAC Name: (3-phenyl-2,1-benzoxazol-5-yl)-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]methanone Traditional Name: (3-phenylanthranil-5-yl)-[4-[2-(4-pyridyl)ethyl]piperazino]methanone Formula: C25H24N4O2 MolecularWeight: 412.48366

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=NC=C2)C(=O)C3=CC4=C(ON=C4C=C3)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCC2=CC=NC=C2)C(=O)C3=CC4=C(ON=C4C=C3)C5=CC=CC=C5

InChI

InChI=1S/C25H24N4O2/c30-25(29-16-14-28(15-17-29)13-10-19-8-11-26-12-9-19)21-6-7-23-22(18-21)24(31-27-23)20-4-2-1-3-5-20/h1-9,11-12,18H,10,13-17H2