butyl 4-[2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]benzoate Openeye Name: butyl 4-[[2-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]thio]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]acetyl]amino]benzoic acid butyl ester Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=NOC(=C2)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=NOC(=C2)C

InChI

InChI=1S/C19H23N3O5S/c1-3-4-9-26-19(25)14-5-7-15(8-6-14)20-17(23)11-28-12-18(24)21-16-10-13(2)27-22-16/h5-8,10H,3-4,9,11-12H2,1-2H3,(H,20,23)(H,21,22,24)