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5-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

5-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

Systemtic Name:5-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile
Openeye Name:5-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CAS Name:5-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile
IUPAC Name:5-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile
Traditional Name:5-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-7-keto-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile
Formula: C16H12N4O3S
MolecularWeight: 340.35648
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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)SCC3=CC(=O)N4C(=N3)C(=CN4)C#N


Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)SCC3=CC(=O)N4C(=N3)C(=CN4)C#N


InChI

InChI=1S/C16H12N4O3S/c17-7-10-8-18-20-15(21)5-11(19-16(10)20)9-24-12-1-2-13-14(6-12)23-4-3-22-13/h1-2,5-6,8,18H,3-4,9H2


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