methyl 5,5-bis(butylsulfanyl)-2,4,6-tris(oxidanylidene)-1,3-diazinane-1-carboxylate

Systemtic Name: methyl 5,5-bis(butylsulfanyl)-2,4,6-tris(oxidanylidene)-1,3-diazinane-1-carboxylate Openeye Name: methyl 5,5-bis(butylsulfanyl)-2,4,6-trioxo-hexahydropyrimidine-1-carboxylate CAS Name: 5,5-bis(butylthio)-2,4,6-trioxo-1,3-diazinane-1-carboxylic acid methyl ester IUPAC Name: methyl 5,5-bis(butylsulfanyl)-2,4,6-trioxo-1,3-diazinane-1-carboxylate Traditional Name: 5,5-bis(butylthio)-2,4,6-triketo-hexahydropyrimidine-1-carboxylic acid methyl ester Formula: C14H22N2O5S2 MolecularWeight: 362.46488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1(C(=O)NC(=O)N(C1=O)C(=O)OC)SCCCC

Isomeric SMILES

CCCCSC1(C(=O)NC(=O)N(C1=O)C(=O)OC)SCCCC

InChI

InChI=1S/C14H22N2O5S2/c1-4-6-8-22-14(23-9-7-5-2)10(17)15-12(19)16(11(14)18)13(20)21-3/h4-9H2,1-3H3,(H,15,17,19)