2-[4-[[5-(4-methoxyphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-[[5-(4-methoxyphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-[[5-(4-methoxyphenyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[[5-(4-methoxyphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-[[5-(4-methoxyphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-[[5-(4-methoxyphenyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]piperazino]isonicotinonitrile Formula: C20H20N6O2S MolecularWeight: 408.4768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=S)O2)CN3CCN(CC3)C4=NC=CC(=C4)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=S)O2)CN3CCN(CC3)C4=NC=CC(=C4)C#N

InChI

InChI=1S/C20H20N6O2S/c1-27-17-4-2-16(3-5-17)19-23-26(20(29)28-19)14-24-8-10-25(11-9-24)18-12-15(13-21)6-7-22-18/h2-7,12H,8-11,14H2,1H3