butyl 4-[[2-(phenylcarbamoylamino)-1,3-thiazol-4-yl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[2-(phenylcarbamoylamino)-1,3-thiazol-4-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[2-(phenylcarbamoylamino)thiazole-4-carbonyl]amino]benzoate CAS Name: 4-[[[2-[[anilino(oxo)methyl]amino]-4-thiazolyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-(phenylcarbamoylamino)-1,3-thiazole-4-carbonyl]amino]benzoate Traditional Name: 4-[[2-(phenylcarbamoylamino)thiazole-4-carbonyl]amino]benzoic acid butyl ester Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CSC(=N2)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CSC(=N2)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H22N4O4S/c1-2-3-13-30-20(28)15-9-11-17(12-10-15)23-19(27)18-14-31-22(25-18)26-21(29)24-16-7-5-4-6-8-16/h4-12,14H,2-3,13H2,1H3,(H,23,27)(H2,24,25,26,29)