propyl 4-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanoyl]amino]benzoate

Systemtic Name: propyl 4-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfanyl-butanoyl]amino]benzoate Openeye Name: propyl 4-[[2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfanyl-butanoyl]amino]benzoate CAS Name: 4-[[2-(1,3-dioxo-2-isoindolyl)-4-(methylthio)-1-oxobutyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanylbutanoyl]amino]benzoate Traditional Name: 4-[[4-(methylthio)-2-phthalimido-butanoyl]amino]benzoic acid propyl ester Formula: C23H24N2O5S MolecularWeight: 440.51206

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C(CCSC)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C(CCSC)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C23H24N2O5S/c1-3-13-30-23(29)15-8-10-16(11-9-15)24-20(26)19(12-14-31-2)25-21(27)17-6-4-5-7-18(17)22(25)28/h4-11,19H,3,12-14H2,1-2H3,(H,24,26)