[2-oxidanylidene-2-(4-phenylphenyl)ethyl] 2-[2-[(4-butoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-(4-phenylphenyl)ethyl] 2-[2-[(4-butoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: [2-oxo-2-(4-phenylphenyl)ethyl] 2-[2-(4-butoxyanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(4-butoxyanilino)-2-oxoethyl]thio]acetic acid [2-oxo-2-(4-phenylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylphenyl)ethyl] 2-[2-(4-butoxyanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(4-butoxyanilino)-2-keto-ethyl]thio]acetic acid [2-keto-2-(4-phenylphenyl)ethyl] ester Formula: C28H29NO5S MolecularWeight: 491.59856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=O)CSCC(=O)OCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=O)CSCC(=O)OCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C28H29NO5S/c1-2-3-17-33-25-15-13-24(14-16-25)29-27(31)19-35-20-28(32)34-18-26(30)23-11-9-22(10-12-23)21-7-5-4-6-8-21/h4-16H,2-3,17-20H2,1H3,(H,29,31)