methyl (4S,5S)-2-oxidanylidene-5-propyl-6-sulfanylidene-1,3-diazinane-4-carboxylate

Systemtic Name: methyl (4S,5S)-2-oxidanylidene-5-propyl-6-sulfanylidene-1,3-diazinane-4-carboxylate Openeye Name: methyl (4S,5S)-2-oxo-5-propyl-6-thioxo-hexahydropyrimidine-4-carboxylate CAS Name: (4S,5S)-2-oxo-5-propyl-6-sulfanylidene-1,3-diazinane-4-carboxylic acid methyl ester IUPAC Name: methyl (4S,5S)-2-oxo-5-propyl-6-sulfanylidene-1,3-diazinane-4-carboxylate Traditional Name: (4S,5S)-2-keto-5-propyl-6-thioxo-hexahydropyrimidine-4-carboxylic acid methyl ester Formula: C9H14N2O3S MolecularWeight: 230.28406

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(NC(=O)NC1=S)C(=O)OC

Isomeric SMILES

CCC[C@H]1[C@H](NC(=O)NC1=S)C(=O)OC

InChI

InChI=1S/C9H14N2O3S/c1-3-4-5-6(8(12)14-2)10-9(13)11-7(5)15/h5-6H,3-4H2,1-2H3,(H2,10,11,13,15)/t5-,6-/m0/s1