N-[5-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoylamino]-2-methoxy-phenyl]-4-ethylsulfanyl-4-methyl-3-oxidanylidene-pentanamide

Systemtic Name: N-[5-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoylamino]-2-methoxy-phenyl]-4-ethylsulfanyl-4-methyl-3-oxidanylidene-pentanamide Openeye Name: N-[5-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butanoylamino]-2-methoxy-phenyl]-4-ethylsulfanyl-4-methyl-3-oxo-pentanamide CAS Name: N-[5-[[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-1-oxobutyl]amino]-2-methoxyphenyl]-4-(ethylthio)-4-methyl-3-oxopentanamide IUPAC Name: N-[5-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoylamino]-2-methoxyphenyl]-4-ethylsulfanyl-4-methyl-3-oxopentanamide Traditional Name: N-[5-[4-(2,4-ditert-amylphenoxy)butanoylamino]-2-methoxy-phenyl]-4-(ethylthio)-3-keto-4-methyl-valeramide Formula: C35H52N2O5S MolecularWeight: 612.86278

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)OC)NC(=O)CC(=O)C(C)(C)SCC)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)OC)NC(=O)CC(=O)C(C)(C)SCC)C(C)(C)CC

InChI

InChI=1S/C35H52N2O5S/c1-11-33(4,5)24-16-18-28(26(21-24)34(6,7)12-2)42-20-14-15-31(39)36-25-17-19-29(41-10)27(22-25)37-32(40)23-30(38)35(8,9)43-13-3/h16-19,21-22H,11-15,20,23H2,1-10H3,(H,36,39)(H,37,40)