N-(3-cyanophenyl)-4-pyrimidin-2-ylsulfanyl-butanamide

Systemtic Name: N-(3-cyanophenyl)-4-pyrimidin-2-ylsulfanyl-butanamide Openeye Name: N-(3-cyanophenyl)-4-pyrimidin-2-ylsulfanyl-butanamide CAS Name: N-(3-cyanophenyl)-4-(2-pyrimidinylthio)butanamide IUPAC Name: N-(3-cyanophenyl)-4-pyrimidin-2-ylsulfanylbutanamide Traditional Name: N-(3-cyanophenyl)-4-(2-pyrimidylthio)butyramide Formula: C15H14N4OS MolecularWeight: 298.36286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCCSC2=NC=CC=N2)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCCSC2=NC=CC=N2)C#N

InChI

InChI=1S/C15H14N4OS/c16-11-12-4-1-5-13(10-12)19-14(20)6-2-9-21-15-17-7-3-8-18-15/h1,3-5,7-8,10H,2,6,9H2,(H,19,20)