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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(N=C(O3)COC4=CC(=CC=C4)Br)C#N

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(N=C(O3)COC4=CC(=CC=C4)Br)C#N

InChI

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