6-(furan-2-yl)-2-(2-methylpropylsulfanyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(furan-2-yl)-2-(2-methylpropylsulfanyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(2-furyl)-2-isobutylsulfanyl-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(2-furanyl)-2-(2-methylpropylthio)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(furan-2-yl)-2-(2-methylpropylsulfanyl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(2-furyl)-2-(isobutylthio)-4-keto-1H-pyrimidine-5-carbonitrile Formula: C13H13N3O2S MolecularWeight: 275.32622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NC(=O)C(=C(N1)C2=CC=CO2)C#N

Isomeric SMILES

CC(C)CSC1=NC(=O)C(=C(N1)C2=CC=CO2)C#N

InChI

InChI=1S/C13H13N3O2S/c1-8(2)7-19-13-15-11(10-4-3-5-18-10)9(6-14)12(17)16-13/h3-5,8H,7H2,1-2H3,(H,15,16,17)