propan-2-yl 4-[[2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylphenyl]carbonylamino]benzoate

Systemtic Name: propan-2-yl 4-[[2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylphenyl]carbonylamino]benzoate Openeye Name: isopropyl 4-[[2-[2-(isopropylamino)-2-oxo-ethyl]sulfanylbenzoyl]amino]benzoate CAS Name: 4-[[oxo-[2-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]phenyl]methyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylbenzoyl]amino]benzoate Traditional Name: 4-[[2-[[2-(isopropylamino)-2-keto-ethyl]thio]benzoyl]amino]benzoic acid isopropyl ester Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)OC(C)C

Isomeric SMILES

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)OC(C)C

InChI

InChI=1S/C22H26N2O4S/c1-14(2)23-20(25)13-29-19-8-6-5-7-18(19)21(26)24-17-11-9-16(10-12-17)22(27)28-15(3)4/h5-12,14-15H,13H2,1-4H3,(H,23,25)(H,24,26)