butyl 4-[[4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]phenyl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]phenyl]carbonylamino]benzoate Openeye Name: butyl 4-[[4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzoyl]amino]benzoate CAS Name: 4-[[[4-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]phenyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzoyl]amino]benzoate Traditional Name: 4-[[4-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]benzoyl]amino]benzoic acid butyl ester Formula: C24H26N4O4S MolecularWeight: 466.55264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=CN3C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC=CN3C

InChI

InChI=1S/C24H26N4O4S/c1-3-4-15-32-23(31)18-7-11-20(12-8-18)27-22(30)17-5-9-19(10-6-17)26-21(29)16-33-24-25-13-14-28(24)2/h5-14H,3-4,15-16H2,1-2H3,(H,26,29)(H,27,30)