[2-(butylamino)-2-oxidanylidene-ethyl] 2-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 2-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 2-[2-(3-methoxyanilino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(3-methoxyanilino)-2-oxoethyl]thio]benzoic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 2-[2-(3-methoxyanilino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-keto-2-(m-anisidino)ethyl]thio]benzoic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=CC=CC=C1SCC(=O)NC2=CC(=CC=C2)OC

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=CC=CC=C1SCC(=O)NC2=CC(=CC=C2)OC

InChI

InChI=1S/C22H26N2O5S/c1-3-4-12-23-20(25)14-29-22(27)18-10-5-6-11-19(18)30-15-21(26)24-16-8-7-9-17(13-16)28-2/h5-11,13H,3-4,12,14-15H2,1-2H3,(H,23,25)(H,24,26)