6-propyl-2-sulfanylidene-1H-pyrimidin-4-one; 2,2,3,3-tetrakis(chloranyl)thiirane; hydrochloride

Systemtic Name: 6-propyl-2-sulfanylidene-1H-pyrimidin-4-one; 2,2,3,3-tetrakis(chloranyl)thiirane; hydrochloride Openeye Name: 6-propyl-2-thioxo-1H-pyrimidin-4-one; 2,2,3,3-tetrachlorothiirane; hydrochloride CAS Name: 6-propyl-2-sulfanylidene-1H-pyrimidin-4-one; 2,2,3,3-tetrachlorothiirane; hydrochloride IUPAC Name: 6-propyl-2-sulfanylidene-1H-pyrimidin-4-one; 2,2,3,3-tetrachlorothiirane; hydrochloride Traditional Name: 6-propyl-2-thioxo-1H-pyrimidin-4-one; 2,2,3,3-tetrachlorothiirane; hydrochloride Formula: C9H11Cl5N2OS2 MolecularWeight: 404.59144

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)NC(=S)N1.C1(C(S1)(Cl)Cl)(Cl)Cl.Cl

Isomeric SMILES

CCCC1=CC(=O)NC(=S)N1.C1(C(S1)(Cl)Cl)(Cl)Cl.Cl

InChI

InChI=1S/C7H10N2OS.C2Cl4S.ClH/c1-2-3-5-4-6(10)9-7(11)8-5;3-1(4)2(5,6)7-1;/h4H,2-3H2,1H3,(H2,8,9,10,11);;1H