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

Systemtic Name: 2-methyl-5-[4-(2-pyridin-2-ylsulfanylethanoyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-methyl-5-[4-[2-(2-pyridylsulfanyl)acetyl]piperazin-1-yl]oxazole-4-carbonitrile CAS Name: 2-methyl-5-[4-[1-oxo-2-(2-pyridinylthio)ethyl]-1-piperazinyl]-4-oxazolecarbonitrile IUPAC Name: 2-methyl-5-[4-(2-pyridin-2-ylsulfanylacetyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 2-methyl-5-[4-[2-(2-pyridylthio)acetyl]piperazino]oxazole-4-carbonitrile Formula: C16H17N5O2S MolecularWeight: 343.40348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(O1)N2CCN(CC2)C(=O)CSC3=CC=CC=N3)C#N

Isomeric SMILES

CC1=NC(=C(O1)N2CCN(CC2)C(=O)CSC3=CC=CC=N3)C#N

InChI

InChI=1S/C16H17N5O2S/c1-12-19-13(10-17)16(23-12)21-8-6-20(7-9-21)15(22)11-24-14-4-2-3-5-18-14/h2-5H,6-9,11H2,1H3