5-(pyrimidin-5-ylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 5-(pyrimidin-5-ylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 5-(pyrimidin-5-ylmethyl)-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-(5-pyrimidinylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-(pyrimidin-5-ylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 5-(5-pyrimidylmethyl)-2-thioxo-1H-pyrimidin-4-one Formula: C9H8N4OS MolecularWeight: 220.25102

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)NC(=S)N1)CC2=CN=CN=C2

Isomeric SMILES

C1=C(C(=O)NC(=S)N1)CC2=CN=CN=C2

InChI

InChI=1S/C9H8N4OS/c14-8-7(4-12-9(15)13-8)1-6-2-10-5-11-3-6/h2-5H,1H2,(H2,12,13,14,15)