[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoate Openeye Name: (1-allophanoyl-2-methyl-propyl) 4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoate CAS Name: 4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoate Traditional Name: 4-(3-phenyl-1,2,4-oxadiazol-5-yl)butyric acid (1-allophanoyl-2-methyl-propyl) ester Formula: C18H22N4O5 MolecularWeight: 374.39108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)CCCC1=NC(=NO1)C2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)NC(=O)N)OC(=O)CCCC1=NC(=NO1)C2=CC=CC=C2

InChI

InChI=1S/C18H22N4O5/c1-11(2)15(17(24)21-18(19)25)26-14(23)10-6-9-13-20-16(22-27-13)12-7-4-3-5-8-12/h3-5,7-8,11,15H,6,9-10H2,1-2H3,(H3,19,21,24,25)