N-(2-cyanophenyl)-3-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide

Systemtic Name: N-(2-cyanophenyl)-3-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: N-(2-cyanophenyl)-3-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: N-(2-cyanophenyl)-3-[(6-oxo-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: N-(2-cyanophenyl)-3-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: N-(2-cyanophenyl)-3-[(6-keto-1H-pyrimidin-2-yl)thio]propionamide Formula: C14H12N4O2S MolecularWeight: 300.33568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)NC(=O)CCSC2=NC=CC(=O)N2

Isomeric SMILES

C1=CC=C(C(=C1)C#N)NC(=O)CCSC2=NC=CC(=O)N2

InChI

InChI=1S/C14H12N4O2S/c15-9-10-3-1-2-4-11(10)17-13(20)6-8-21-14-16-7-5-12(19)18-14/h1-5,7H,6,8H2,(H,17,20)(H,16,18,19)