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

Systemtic Name: (E,2R,10S)-2-butyl-2-[2-ethanoyl-2-(1H-imidazol-5-yl)hydrazinyl]-10-methyl-4-methylsulfanyl-5-oxidanylidene-dodec-7-enoic acid Openeye Name: (E,2R,10S)-2-[2-acetyl-2-(1H-imidazol-5-yl)hydrazino]-2-butyl-10-methyl-4-methylsulfanyl-5-oxo-dodec-7-enoic acid CAS Name: (E,2R,10S)-2-[2-acetyl-2-(1H-imidazol-5-yl)hydrazinyl]-2-butyl-10-methyl-4-(methylthio)-5-oxo-7-dodecenoic acid IUPAC Name: (E,2R,10S)-2-[2-acetyl-2-(1H-imidazol-5-yl)hydrazinyl]-2-butyl-10-methyl-4-methylsulfanyl-5-oxododec-7-enoic acid Traditional Name: (E,2R,10S)-2-[N'-acetyl-N'-(1H-imidazol-5-yl)hydrazino]-2-butyl-5-keto-10-methyl-4-(methylthio)dodec-7-enoic acid Formula: C23H38N4O4S MolecularWeight: 466.63722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H38N4O4S/c1-6-8-13-23(22(30)31,26-27(18(4)28)21-15-24-16-25-21)14-20(32-5)19(29)12-10-9-11-17(3)7-2/h9-10,15-17,20,26H,6-8,11-14H2,1-5H3,(H,24,25)(H,30,31)/b10-9+/t17-,20?,23+/m0/s1