ethyl 3-azanylidene-2-(phenoxycarbonylsulfanylcarbamoyl)hexanoate

Systemtic Name: ethyl 3-azanylidene-2-(phenoxycarbonylsulfanylcarbamoyl)hexanoate Openeye Name: ethyl 3-imino-2-(phenoxycarbonylsulfanylcarbamoyl)hexanoate CAS Name: 3-imino-2-[oxo-[[[oxo(phenoxy)methyl]thio]amino]methyl]hexanoic acid ethyl ester IUPAC Name: ethyl 3-imino-2-(phenoxycarbonylsulfanylcarbamoyl)hexanoate Traditional Name: 2-[(carbophenoxythio)carbamoyl]-3-imino-hexanoic acid ethyl ester Formula: C16H20N2O5S MolecularWeight: 352.4054

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=N)C(C(=O)NSC(=O)OC1=CC=CC=C1)C(=O)OCC

Isomeric SMILES

CCCC(=N)C(C(=O)NSC(=O)OC1=CC=CC=C1)C(=O)OCC

InChI

InChI=1S/C16H20N2O5S/c1-3-8-12(17)13(15(20)22-4-2)14(19)18-24-16(21)23-11-9-6-5-7-10-11/h5-7,9-10,13,17H,3-4,8H2,1-2H3,(H,18,19)