4-[[4-[3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[3-[2-oxo-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propanoyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[1-oxo-3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[3-[2-keto-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propanoyl]piperazino]methyl]benzonitrile Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CCN3C(=O)OC(=N3)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CCN3C(=O)OC(=N3)C4=CC=CS4

InChI

InChI=1S/C21H21N5O3S/c22-14-16-3-5-17(6-4-16)15-24-9-11-25(12-10-24)19(27)7-8-26-21(28)29-20(23-26)18-2-1-13-30-18/h1-6,13H,7-12,15H2