(E,2R,10S)-2-butyl-2-[2-(1H-imidazol-5-ylcarbonyl)hydrazinyl]-10-methyl-4-methylsulfanyl-5-oxidanylidene-dodec-7-enoic acid

Systemtic Name: (E,2R,10S)-2-butyl-2-[2-(1H-imidazol-5-ylcarbonyl)hydrazinyl]-10-methyl-4-methylsulfanyl-5-oxidanylidene-dodec-7-enoic acid Openeye Name: (E,2R,10S)-2-butyl-2-[2-(1H-imidazole-5-carbonyl)hydrazino]-10-methyl-4-methylsulfanyl-5-oxo-dodec-7-enoic acid CAS Name: (E,2R,10S)-2-butyl-2-[[1H-imidazol-5-yl(oxo)methyl]hydrazo]-10-methyl-4-(methylthio)-5-oxo-7-dodecenoic acid IUPAC Name: (E,2R,10S)-2-butyl-2-[2-(1H-imidazole-5-carbonyl)hydrazinyl]-10-methyl-4-methylsulfanyl-5-oxododec-7-enoic acid Traditional Name: (E,2R,10S)-2-butyl-2-[N'-(1H-imidazole-5-carbonyl)hydrazino]-5-keto-10-methyl-4-(methylthio)dodec-7-enoic acid Formula: C22H36N4O4S MolecularWeight: 452.61064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(C(=O)CC=CCC(C)CC)SC)(C(=O)O)NNC(=O)C1=CN=CN1

Isomeric SMILES

CCCC[C@@](CC(C(=O)C/C=C/C[C@@H](C)CC)SC)(C(=O)O)NNC(=O)C1=CN=CN1

InChI

InChI=1S/C22H36N4O4S/c1-5-7-12-22(21(29)30,26-25-20(28)17-14-23-15-24-17)13-19(31-4)18(27)11-9-8-10-16(3)6-2/h8-9,14-16,19,26H,5-7,10-13H2,1-4H3,(H,23,24)(H,25,28)(H,29,30)/b9-8+/t16-,19?,22+/m0/s1