[1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate

Systemtic Name: [1-(tert-butylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: [2-(tert-butylcarbamoylamino)-1-methyl-2-oxo-ethyl] 5-methyl-2-phenyl-triazole-4-carboxylate CAS Name: 5-methyl-2-phenyl-4-triazolecarboxylic acid [1-[[(tert-butylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-(tert-butylcarbamoylamino)-1-oxopropan-2-yl] 5-methyl-2-phenyltriazole-4-carboxylate Traditional Name: 5-methyl-2-phenyl-triazole-4-carboxylic acid [2-(tert-butylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H23N5O4 MolecularWeight: 373.40632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)OC(C)C(=O)NC(=O)NC(C)(C)C)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(N=C1C(=O)OC(C)C(=O)NC(=O)NC(C)(C)C)C2=CC=CC=C2

InChI

InChI=1S/C18H23N5O4/c1-11-14(22-23(21-11)13-9-7-6-8-10-13)16(25)27-12(2)15(24)19-17(26)20-18(3,4)5/h6-10,12H,1-5H3,(H2,19,20,24,26)