ethyl 2-azanyl-5-[[1-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-3-octylsulfanyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: ethyl 2-azanyl-5-[[1-[(2-ethoxy-2-oxidanylidene-ethyl)amino]-3-octylsulfanyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: ethyl 2-amino-5-[[2-[(2-ethoxy-2-oxo-ethyl)amino]-1-(octylsulfanylmethyl)-2-oxo-ethyl]amino]-5-oxo-pentanoate CAS Name: 2-amino-5-[[1-[(2-ethoxy-2-oxoethyl)amino]-3-(octylthio)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid ethyl ester IUPAC Name: ethyl 2-amino-5-[[1-[(2-ethoxy-2-oxoethyl)amino]-3-octylsulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoate Traditional Name: 2-amino-5-[[2-[(2-ethoxy-2-keto-ethyl)amino]-2-keto-1-[(octylthio)methyl]ethyl]amino]-5-keto-valeric acid ethyl ester Formula: C22H41N3O6S MolecularWeight: 475.64244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSCC(C(=O)NCC(=O)OCC)NC(=O)CCC(C(=O)OCC)N

Isomeric SMILES

CCCCCCCCSCC(C(=O)NCC(=O)OCC)NC(=O)CCC(C(=O)OCC)N

InChI

InChI=1S/C22H41N3O6S/c1-4-7-8-9-10-11-14-32-16-18(21(28)24-15-20(27)30-5-2)25-19(26)13-12-17(23)22(29)31-6-3/h17-18H,4-16,23H2,1-3H3,(H,24,28)(H,25,26)