diethyl 2-acetamido-2-[4-(2H-1,2,3,4-tetrazol-5-ylsulfanyl)butyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[4-(2H-1,2,3,4-tetrazol-5-ylsulfanyl)butyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[4-(2H-tetrazol-5-ylsulfanyl)butyl]propanedioate CAS Name: 2-acetamido-2-[4-(2H-tetrazol-5-ylthio)butyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[4-(2H-tetrazol-5-ylsulfanyl)butyl]propanedioate Traditional Name: 2-acetamido-2-[4-(2H-tetrazol-5-ylthio)butyl]malonic acid diethyl ester Formula: C14H23N5O5S MolecularWeight: 373.42792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCSC1=NNN=N1)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CCCCSC1=NNN=N1)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C14H23N5O5S/c1-4-23-11(21)14(15-10(3)20,12(22)24-5-2)8-6-7-9-25-13-16-18-19-17-13/h4-9H2,1-3H3,(H,15,20)(H,16,17,18,19)