4-oxidanylidene-2-propylsulfanyl-6-pyridin-4-yl-1H-pyrimidine-5-carbonitrile

Systemtic Name: 4-oxidanylidene-2-propylsulfanyl-6-pyridin-4-yl-1H-pyrimidine-5-carbonitrile Openeye Name: 4-oxo-2-propylsulfanyl-6-(4-pyridyl)-1H-pyrimidine-5-carbonitrile CAS Name: 4-oxo-2-(propylthio)-6-pyridin-4-yl-1H-pyrimidine-5-carbonitrile IUPAC Name: 4-oxo-2-propylsulfanyl-6-pyridin-4-yl-1H-pyrimidine-5-carbonitrile Traditional Name: 4-keto-2-(propylthio)-6-(4-pyridyl)-1H-pyrimidine-5-carbonitrile Formula: C13H12N4OS MolecularWeight: 272.32558

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=O)C(=C(N1)C2=CC=NC=C2)C#N

Isomeric SMILES

CCCSC1=NC(=O)C(=C(N1)C2=CC=NC=C2)C#N

InChI

InChI=1S/C13H12N4OS/c1-2-7-19-13-16-11(9-3-5-15-6-4-9)10(8-14)12(18)17-13/h3-6H,2,7H2,1H3,(H,16,17,18)