O3,O3-diethyl O1-[methyl(methylsulfanylcarbothioyl)amino] hex-5-ene-1,3,3-tricarboxylate

Systemtic Name: O3,O3-diethyl O1-[methyl(methylsulfanylcarbothioyl)amino] hex-5-ene-1,3,3-tricarboxylate Openeye Name: O3,O3-diethyl O1-[methyl(methylsulfanylcarbothioyl)amino] hex-5-ene-1,3,3-tricarboxylate CAS Name: 5-hexene-1,3,3-tricarboxylic acid O3,O3-diethyl ester O1-[methyl-[(methylthio)-sulfanylidenemethyl]amino] ester IUPAC Name: 3-O,3-O-diethyl 1-O-[methyl(methylsulfanylcarbothioyl)amino] hex-5-ene-1,3,3-tricarboxylate Traditional Name: hex-5-ene-1,3,3-tricarboxylic acid O3,O3-diethyl ester O1-[methyl-(methylthio)carbothioyl-amino] ester Formula: C16H25NO6S2 MolecularWeight: 391.5028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(=O)ON(C)C(=S)SC)(CC=C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CCC(=O)ON(C)C(=S)SC)(CC=C)C(=O)OCC

InChI

InChI=1S/C16H25NO6S2/c1-6-10-16(13(19)21-7-2,14(20)22-8-3)11-9-12(18)23-17(4)15(24)25-5/h6H,1,7-11H2,2-5H3