3-[3-[4-(3-ethyl-2-oxidanylidene-1,3-benzoxazol-7-yl)piperazin-1-yl]propyl]-1-benzofuran-5-carbonitrile

Systemtic Name: 3-[3-[4-(3-ethyl-2-oxidanylidene-1,3-benzoxazol-7-yl)piperazin-1-yl]propyl]-1-benzofuran-5-carbonitrile Openeye Name: 3-[3-[4-(3-ethyl-2-oxo-1,3-benzoxazol-7-yl)piperazin-1-yl]propyl]benzofuran-5-carbonitrile CAS Name: 3-[3-[4-(3-ethyl-2-oxo-1,3-benzoxazol-7-yl)-1-piperazinyl]propyl]-5-benzofurancarbonitrile IUPAC Name: 3-[3-[4-(3-ethyl-2-oxo-1,3-benzoxazol-7-yl)piperazin-1-yl]propyl]-1-benzofuran-5-carbonitrile Traditional Name: 3-[3-[4-(3-ethyl-2-keto-1,3-benzoxazol-7-yl)piperazino]propyl]benzofuran-5-carbonitrile Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=CC=C2)N3CCN(CC3)CCCC4=COC5=C4C=C(C=C5)C#N)OC1=O

Isomeric SMILES

CCN1C2=C(C(=CC=C2)N3CCN(CC3)CCCC4=COC5=C4C=C(C=C5)C#N)OC1=O

InChI

InChI=1S/C25H26N4O3/c1-2-29-22-7-3-6-21(24(22)32-25(29)30)28-13-11-27(12-14-28)10-4-5-19-17-31-23-9-8-18(16-26)15-20(19)23/h3,6-9,15,17H,2,4-5,10-14H2,1H3