2-[(4-chloranylphenoxy)methyl]-5-[(2-piperidin-1-yl-2-thiophen-2-yl-ethyl)amino]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-[(4-chloranylphenoxy)methyl]-5-[(2-piperidin-1-yl-2-thiophen-2-yl-ethyl)amino]-1,3-oxazole-4-carbonitrile Openeye Name: 2-[(4-chlorophenoxy)methyl]-5-[[2-(1-piperidyl)-2-(2-thienyl)ethyl]amino]oxazole-4-carbonitrile CAS Name: 2-[(4-chlorophenoxy)methyl]-5-[[2-(1-piperidinyl)-2-thiophen-2-ylethyl]amino]-4-oxazolecarbonitrile IUPAC Name: 2-[(4-chlorophenoxy)methyl]-5-[(2-piperidin-1-yl-2-thiophen-2-ylethyl)amino]-1,3-oxazole-4-carbonitrile Traditional Name: 2-[(4-chlorophenoxy)methyl]-5-[[2-piperidino-2-(2-thienyl)ethyl]amino]oxazole-4-carbonitrile Formula: C22H23ClN4O2S MolecularWeight: 442.96162

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(CNC2=C(N=C(O2)COC3=CC=C(C=C3)Cl)C#N)C4=CC=CS4

Isomeric SMILES

C1CCN(CC1)C(CNC2=C(N=C(O2)COC3=CC=C(C=C3)Cl)C#N)C4=CC=CS4

InChI

InChI=1S/C22H23ClN4O2S/c23-16-6-8-17(9-7-16)28-15-21-26-18(13-24)22(29-21)25-14-19(20-5-4-12-30-20)27-10-2-1-3-11-27/h4-9,12,19,25H,1-3,10-11,14-15H2