methyl 5-[[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-pentyl-amino]-4-(naphthalen-2-ylsulfanylmethyl)-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-pentyl-amino]-4-(naphthalen-2-ylsulfanylmethyl)-5-oxidanylidene-pentanoate Openeye Name: methyl 5-[(2-tert-butoxy-2-oxo-ethyl)-pentyl-amino]-4-(2-naphthylsulfanylmethyl)-5-oxo-pentanoate CAS Name: 5-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-pentylamino]-4-[(2-naphthalenylthio)methyl]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-pentylamino]-4-(naphthalen-2-ylsulfanylmethyl)-5-oxopentanoate Traditional Name: 5-[amyl-(2-tert-butoxy-2-keto-ethyl)amino]-5-keto-4-[(2-naphthylthio)methyl]valeric acid methyl ester Formula: C28H39NO5S MolecularWeight: 501.67796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)OC(C)(C)C)C(=O)C(CCC(=O)OC)CSC1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CCCCCN(CC(=O)OC(C)(C)C)C(=O)C(CCC(=O)OC)CSC1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C28H39NO5S/c1-6-7-10-17-29(19-26(31)34-28(2,3)4)27(32)23(14-16-25(30)33-5)20-35-24-15-13-21-11-8-9-12-22(21)18-24/h8-9,11-13,15,18,23H,6-7,10,14,16-17,19-20H2,1-5H3