N-(4-cyanophenyl)-2-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-(4-cyanophenyl)-2-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-(4-cyanophenyl)-2-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-(4-cyanophenyl)-2-(2-pyrimidinylthio)propanamide IUPAC Name: N-(4-cyanophenyl)-2-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-(4-cyanophenyl)-2-(2-pyrimidylthio)propionamide Formula: C14H12N4OS MolecularWeight: 284.33628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C#N)SC2=NC=CC=N2

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C#N)SC2=NC=CC=N2

InChI

InChI=1S/C14H12N4OS/c1-10(20-14-16-7-2-8-17-14)13(19)18-12-5-3-11(9-15)4-6-12/h2-8,10H,1H3,(H,18,19)