N-[5-cyano-4-(furan-2-yl)-6-(2-pyridin-2-ylethylsulfanyl)pyrimidin-2-yl]benzamide

Systemtic Name: N-[5-cyano-4-(furan-2-yl)-6-(2-pyridin-2-ylethylsulfanyl)pyrimidin-2-yl]benzamide Openeye Name: N-[5-cyano-4-(2-furyl)-6-[2-(2-pyridyl)ethylsulfanyl]pyrimidin-2-yl]benzamide CAS Name: N-[5-cyano-4-(2-furanyl)-6-[2-(2-pyridinyl)ethylthio]-2-pyrimidinyl]benzamide IUPAC Name: N-[5-cyano-4-(furan-2-yl)-6-(2-pyridin-2-ylethylsulfanyl)pyrimidin-2-yl]benzamide Traditional Name: N-[5-cyano-4-(2-furyl)-6-[2-(2-pyridyl)ethylthio]pyrimidin-2-yl]benzamide Formula: C23H17N5O2S MolecularWeight: 427.47838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=NC(=C(C(=N2)SCCC3=CC=CC=N3)C#N)C4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=NC(=C(C(=N2)SCCC3=CC=CC=N3)C#N)C4=CC=CO4

InChI

InChI=1S/C23H17N5O2S/c24-15-18-20(19-10-6-13-30-19)26-23(27-21(29)16-7-2-1-3-8-16)28-22(18)31-14-11-17-9-4-5-12-25-17/h1-10,12-13H,11,14H2,(H,26,27,28,29)