2-azanyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methylsulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 2-amino-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 2-amino-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(methylthio)pyrimidine-5-carbonitrile Formula: C14H12N4O2S MolecularWeight: 300.33568

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1C#N)C2=CC3=C(C=C2)OCCO3)N

Isomeric SMILES

CSC1=NC(=NC(=C1C#N)C2=CC3=C(C=C2)OCCO3)N

InChI

InChI=1S/C14H12N4O2S/c1-21-13-9(7-15)12(17-14(16)18-13)8-2-3-10-11(6-8)20-5-4-19-10/h2-3,6H,4-5H2,1H3,(H2,16,17,18)