2-(3,4-dimethoxyphenyl)-5-(4-thiophen-2-ylcarbonylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5-(4-thiophen-2-ylcarbonylpiperazin-1-yl)-1,3-oxazole-4-carbonitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-5-[4-(thiophene-2-carbonyl)piperazin-1-yl]oxazole-4-carbonitrile CAS Name: 2-(3,4-dimethoxyphenyl)-5-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-4-oxazolecarbonitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-[4-(thiophene-2-carbonyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-5-[4-(2-thenoyl)piperazino]oxazole-4-carbonitrile Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=C(O2)N3CCN(CC3)C(=O)C4=CC=CS4)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=C(O2)N3CCN(CC3)C(=O)C4=CC=CS4)C#N)OC

InChI

InChI=1S/C21H20N4O4S/c1-27-16-6-5-14(12-17(16)28-2)19-23-15(13-22)21(29-19)25-9-7-24(8-10-25)20(26)18-4-3-11-30-18/h3-6,11-12H,7-10H2,1-2H3