ethyl 1-[(4-methylphenyl)methyl]-5-(2-morpholin-4-ylethanoylamino)-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 1-[(4-methylphenyl)methyl]-5-(2-morpholin-4-ylethanoylamino)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-[(2-morpholinoacetyl)amino]-1-(p-tolylmethyl)triazole-4-carboxylate CAS Name: 1-[(4-methylphenyl)methyl]-5-[[2-(4-morpholinyl)-1-oxoethyl]amino]-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-methylphenyl)methyl]-5-[(2-morpholin-4-ylacetyl)amino]triazole-4-carboxylate Traditional Name: 1-(4-methylbenzyl)-5-[(2-morpholinoacetyl)amino]triazole-4-carboxylic acid ethyl ester Formula: C19H25N5O4 MolecularWeight: 387.4329

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)CC2=CC=C(C=C2)C)NC(=O)CN3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)CC2=CC=C(C=C2)C)NC(=O)CN3CCOCC3

InChI

InChI=1S/C19H25N5O4/c1-3-28-19(26)17-18(20-16(25)13-23-8-10-27-11-9-23)24(22-21-17)12-15-6-4-14(2)5-7-15/h4-7H,3,8-13H2,1-2H3,(H,20,25)