4-[6-chloranyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]butane-1-sulfonic acid

Systemtic Name: 4-[6-chloranyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]butane-1-sulfonic acid Openeye Name: 4-(6-chloro-2,4-dioxo-1H-pyrimidin-5-yl)butane-1-sulfonic acid CAS Name: 4-(6-chloro-2,4-dioxo-1H-pyrimidin-5-yl)-1-butanesulfonic acid IUPAC Name: 4-(6-chloro-2,4-dioxo-1H-pyrimidin-5-yl)butane-1-sulfonic acid Traditional Name: 4-(6-chloro-2,4-diketo-1H-pyrimidin-5-yl)butane-1-sulfonic acid Formula: C8H11ClN2O5S MolecularWeight: 282.70134

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Descriptors Computed from Structure

Canonical SMILES:

C(CCS(=O)(=O)O)CC1=C(NC(=O)NC1=O)Cl

Isomeric SMILES

C(CCS(=O)(=O)O)CC1=C(NC(=O)NC1=O)Cl

InChI

InChI=1S/C8H11ClN2O5S/c9-6-5(7(12)11-8(13)10-6)3-1-2-4-17(14,15)16/h1-4H2,(H,14,15,16)(H2,10,11,12,13)