dimethyl 2-ethoxycarbothioylsulfanyl-4-(methoxycarbonylamino)pentanedioate

Systemtic Name: dimethyl 2-ethoxycarbothioylsulfanyl-4-(methoxycarbonylamino)pentanedioate Openeye Name: dimethyl 2-ethoxycarbothioylsulfanyl-4-(methoxycarbonylamino)pentanedioate CAS Name: 2-[[ethoxy(sulfanylidene)methyl]thio]-4-(methoxycarbonylamino)pentanedioic acid dimethyl ester IUPAC Name: dimethyl 2-ethoxycarbothioylsulfanyl-4-(methoxycarbonylamino)pentanedioate Traditional Name: 2-(carbomethoxyamino)-4-(ethoxycarbothioylthio)glutaric acid dimethyl ester Formula: C12H19NO7S2 MolecularWeight: 353.41176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC(CC(C(=O)OC)NC(=O)OC)C(=O)OC

Isomeric SMILES

CCOC(=S)SC(CC(C(=O)OC)NC(=O)OC)C(=O)OC

InChI

InChI=1S/C12H19NO7S2/c1-5-20-12(21)22-8(10(15)18-3)6-7(9(14)17-2)13-11(16)19-4/h7-8H,5-6H2,1-4H3,(H,13,16)