ethyl (3S,5S)-5-(carbamimidoylsulfanylmethyl)-2-oxidanylidene-3-propyl-oxolane-3-carboxylate

Systemtic Name: ethyl (3S,5S)-5-(carbamimidoylsulfanylmethyl)-2-oxidanylidene-3-propyl-oxolane-3-carboxylate Openeye Name: ethyl (3S,5S)-5-(carbamimidoylsulfanylmethyl)-2-oxo-3-propyl-tetrahydrofuran-3-carboxylate CAS Name: (3S,5S)-5-[(carbamimidoylthio)methyl]-2-oxo-3-propyl-3-oxolanecarboxylic acid ethyl ester IUPAC Name: ethyl (3S,5S)-5-(carbamimidoylsulfanylmethyl)-2-oxo-3-propyloxolane-3-carboxylate Traditional Name: (3S,5S)-5-[(amidinothio)methyl]-2-keto-3-propyl-tetrahydrofuran-3-carboxylic acid ethyl ester Formula: C12H20N2O4S MolecularWeight: 288.3632

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC(OC1=O)CSC(=N)N)C(=O)OCC

Isomeric SMILES

CCC[C@]1(C[C@H](OC1=O)CSC(=N)N)C(=O)OCC

InChI

InChI=1S/C12H20N2O4S/c1-3-5-12(9(15)17-4-2)6-8(18-10(12)16)7-19-11(13)14/h8H,3-7H2,1-2H3,(H3,13,14)/t8-,12-/m0/s1