ethyl 2-azanyl-3-[4-(3-octadecoxy-3-oxidanylidene-propyl)sulfanyl-4-oxidanylidene-butan-2-yl]sulfanyl-propanoate

Systemtic Name: ethyl 2-azanyl-3-[4-(3-octadecoxy-3-oxidanylidene-propyl)sulfanyl-4-oxidanylidene-butan-2-yl]sulfanyl-propanoate Openeye Name: ethyl 2-amino-3-[1-methyl-3-(3-octadecoxy-3-oxo-propyl)sulfanyl-3-oxo-propyl]sulfanyl-propanoate CAS Name: 2-amino-3-[[4-[(3-octadecoxy-3-oxopropyl)thio]-4-oxobutan-2-yl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-amino-3-[4-(3-octadecoxy-3-oxopropyl)sulfanyl-4-oxobutan-2-yl]sulfanylpropanoate Traditional Name: 2-amino-3-[[3-keto-3-[(3-keto-3-stearyloxy-propyl)thio]-1-methyl-propyl]thio]propionic acid ethyl ester Formula: C30H57NO5S2 MolecularWeight: 575.90728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)CCSC(=O)CC(C)SCC(C(=O)OCC)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)CCSC(=O)CC(C)SCC(C(=O)OCC)N

InChI

InChI=1S/C30H57NO5S2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-36-28(32)21-23-37-29(33)24-26(3)38-25-27(31)30(34)35-5-2/h26-27H,4-25,31H2,1-3H3