methyl 2-[2-[3-[(2,6-dimethoxyphenyl)carbonylamino]phenyl]sulfanylpropanoylamino]benzoate

Systemtic Name: methyl 2-[2-[3-[(2,6-dimethoxyphenyl)carbonylamino]phenyl]sulfanylpropanoylamino]benzoate Openeye Name: methyl 2-[2-[3-[(2,6-dimethoxybenzoyl)amino]phenyl]sulfanylpropanoylamino]benzoate CAS Name: 2-[[2-[[3-[[(2,6-dimethoxyphenyl)-oxomethyl]amino]phenyl]thio]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[2-[3-[(2,6-dimethoxybenzoyl)amino]phenyl]sulfanylpropanoylamino]benzoate Traditional Name: 2-[2-[[3-[(2,6-dimethoxybenzoyl)amino]phenyl]thio]propanoylamino]benzoic acid methyl ester Formula: C26H26N2O6S MolecularWeight: 494.55944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(=O)OC)SC2=CC=CC(=C2)NC(=O)C3=C(C=CC=C3OC)OC

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C(=O)OC)SC2=CC=CC(=C2)NC(=O)C3=C(C=CC=C3OC)OC

InChI

InChI=1S/C26H26N2O6S/c1-16(24(29)28-20-12-6-5-11-19(20)26(31)34-4)35-18-10-7-9-17(15-18)27-25(30)23-21(32-2)13-8-14-22(23)33-3/h5-16H,1-4H3,(H,27,30)(H,28,29)