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

Systemtic Name: ethyl 4-[[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-pentyl-carbamoyl]amino]benzoate Openeye Name: ethyl 4-[[[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]-pentyl-carbamoyl]amino]benzoate CAS Name: 4-[[[[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]-pentylamino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-pentylcarbamoyl]amino]benzoate Traditional Name: 4-[[amyl-[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]carbamoyl]amino]benzoic acid ethyl ester Formula: C21H28N4O5 MolecularWeight: 416.47082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)NC1=NOC(=C1)C)C(=O)NC2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCCCCN(CC(=O)NC1=NOC(=C1)C)C(=O)NC2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C21H28N4O5/c1-4-6-7-12-25(14-19(26)23-18-13-15(3)30-24-18)21(28)22-17-10-8-16(9-11-17)20(27)29-5-2/h8-11,13H,4-7,12,14H2,1-3H3,(H,22,28)(H,23,24,26)