5-[4-(3-chlorophenyl)piperazin-1-yl]-2-(3,4-dimethoxyphenyl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]-2-(3,4-dimethoxyphenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]-2-(3,4-dimethoxyphenyl)oxazole-4-carbonitrile CAS Name: 5-[4-(3-chlorophenyl)-1-piperazinyl]-2-(3,4-dimethoxyphenyl)-4-oxazolecarbonitrile IUPAC Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]-2-(3,4-dimethoxyphenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-(3-chlorophenyl)piperazino]-2-(3,4-dimethoxyphenyl)oxazole-4-carbonitrile Formula: C22H21ClN4O3 MolecularWeight: 424.88014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=C(O2)N3CCN(CC3)C4=CC(=CC=C4)Cl)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=C(O2)N3CCN(CC3)C4=CC(=CC=C4)Cl)C#N)OC

InChI

InChI=1S/C22H21ClN4O3/c1-28-19-7-6-15(12-20(19)29-2)21-25-18(14-24)22(30-21)27-10-8-26(9-11-27)17-5-3-4-16(23)13-17/h3-7,12-13H,8-11H2,1-2H3