3-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanamide

Systemtic Name: 3-[(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: 3-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: 3-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: 3-[(4-oxo-6-phenyl-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: 3-[(4-keto-6-phenyl-1H-pyrimidin-2-yl)thio]propionamide Formula: C13H13N3O2S MolecularWeight: 275.32622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)N=C(N2)SCCC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)N=C(N2)SCCC(=O)N

InChI

InChI=1S/C13H13N3O2S/c14-11(17)6-7-19-13-15-10(8-12(18)16-13)9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H2,14,17)(H,15,16,18)