methyl (6E)-6-[(E)-C-(5-methoxy-5-oxidanylidene-pentanoyl)-N-phenylazanyl-carbonimidoyl]sulfanyl-5-oxidanylidene-6-(phenylhydrazinylidene)hexanoate

Systemtic Name: methyl (6E)-6-[(E)-C-(5-methoxy-5-oxidanylidene-pentanoyl)-N-phenylazanyl-carbonimidoyl]sulfanyl-5-oxidanylidene-6-(phenylhydrazinylidene)hexanoate Openeye Name: methyl (6E)-6-[(E)-N-anilino-C-(5-methoxy-5-oxo-pentanoyl)carbonimidoyl]sulfanyl-5-oxo-6-(phenylhydrazono)hexanoate CAS Name: (6E)-6-[[(1E)-6-methoxy-2,6-dioxo-1-(phenylhydrazinylidene)hexyl]thio]-5-oxo-6-(phenylhydrazinylidene)hexanoic acid methyl ester IUPAC Name: methyl (6E)-6-[(E)-N-anilino-C-(5-methoxy-5-oxopentanoyl)carbonimidoyl]sulfanyl-5-oxo-6-(phenylhydrazinylidene)hexanoate Traditional Name: (6E)-6-[[(E)-N-anilino-C-(5-keto-5-methoxy-pentanoyl)carbonimidoyl]thio]-5-keto-6-(phenylhydrazono)hexanoic acid methyl ester Formula: C26H30N4O6S MolecularWeight: 526.6046

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)C(=NNC1=CC=CC=C1)SC(=NNC2=CC=CC=C2)C(=O)CCCC(=O)OC

Isomeric SMILES

COC(=O)CCCC(=O)/C(=N\NC1=CC=CC=C1)/S/C(=N/NC2=CC=CC=C2)/C(=O)CCCC(=O)OC

InChI

InChI=1S/C26H30N4O6S/c1-35-23(33)17-9-15-21(31)25(29-27-19-11-5-3-6-12-19)37-26(22(32)16-10-18-24(34)36-2)30-28-20-13-7-4-8-14-20/h3-8,11-14,27-28H,9-10,15-18H2,1-2H3/b29-25+,30-26+