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2-oxidanylidene-4-(sulfanylmethyl)-5,6-dihydro-1H-pyrimidine-6-carboxylic acid

2-oxidanylidene-4-(sulfanylmethyl)-5,6-dihydro-1H-pyrimidine-6-carboxylic acid

Systemtic Name:2-oxidanylidene-4-(sulfanylmethyl)-5,6-dihydro-1H-pyrimidine-6-carboxylic acid
Openeye Name:2-oxo-4-(sulfanylmethyl)-5,6-dihydro-1H-pyrimidine-6-carboxylic acid
CAS Name:4-(mercaptomethyl)-2-oxo-5,6-dihydro-1H-pyrimidine-6-carboxylic acid
IUPAC Name:2-oxo-4-(sulfanylmethyl)-5,6-dihydro-1H-pyrimidine-6-carboxylic acid
Traditional Name:2-keto-4-(mercaptomethyl)-5,6-dihydro-1H-pyrimidine-6-carboxylic acid
Formula: C6H8N2O3S
MolecularWeight: 188.20432
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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=O)N=C1CS)C(=O)O


Isomeric SMILES

C1C(NC(=O)N=C1CS)C(=O)O


InChI

InChI=1S/C6H8N2O3S/c9-5(10)4-1-3(2-12)7-6(11)8-4/h4,12H,1-2H2,(H,8,11)(H,9,10)


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