2-[(4-bromanylphenoxy)methyl]-5-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-[(4-bromanylphenoxy)methyl]-5-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-[(4-bromophenoxy)methyl]-5-[4-(4-methoxyphenyl)piperazin-1-yl]oxazole-4-carbonitrile CAS Name: 2-[(4-bromophenoxy)methyl]-5-[4-(4-methoxyphenyl)-1-piperazinyl]-4-oxazolecarbonitrile IUPAC Name: 2-[(4-bromophenoxy)methyl]-5-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 2-[(4-bromophenoxy)methyl]-5-[4-(4-methoxyphenyl)piperazino]oxazole-4-carbonitrile Formula: C22H21BrN4O3 MolecularWeight: 469.33114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(N=C(O3)COC4=CC=C(C=C4)Br)C#N

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(N=C(O3)COC4=CC=C(C=C4)Br)C#N

InChI

InChI=1S/C22H21BrN4O3/c1-28-18-8-4-17(5-9-18)26-10-12-27(13-11-26)22-20(14-24)25-21(30-22)15-29-19-6-2-16(23)3-7-19/h2-9H,10-13,15H2,1H3