5-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-2-(furan-2-yl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-2-(furan-2-yl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-1-yl]-2-(2-furyl)oxazole-4-carbonitrile CAS Name: 5-[4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazinyl]-2-(2-furanyl)-4-oxazolecarbonitrile IUPAC Name: 5-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-2-(furan-2-yl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-[2-(azepan-1-yl)-2-keto-ethyl]piperazino]-2-(2-furyl)oxazole-4-carbonitrile Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2CCN(CC2)C3=C(N=C(O3)C4=CC=CO4)C#N

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2CCN(CC2)C3=C(N=C(O3)C4=CC=CO4)C#N

InChI

InChI=1S/C20H25N5O3/c21-14-16-20(28-19(22-16)17-6-5-13-27-17)25-11-9-23(10-12-25)15-18(26)24-7-3-1-2-4-8-24/h5-6,13H,1-4,7-12,15H2