[2-(dicyclohexylamino)-2-oxidanylidene-ethyl] 7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: [2-(dicyclohexylamino)-2-oxidanylidene-ethyl] 7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: [2-(dicyclohexylamino)-2-oxo-ethyl] 7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid [2-(dicyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(dicyclohexylamino)-2-oxoethyl] 7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid [2-(dicyclohexylamino)-2-keto-ethyl] ester Formula: C22H31N5O3 MolecularWeight: 413.51324

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NC2=NC=NN12)C(=O)OCC(=O)N(C3CCCCC3)C4CCCCC4

Isomeric SMILES

CCC1=C(C=NC2=NC=NN12)C(=O)OCC(=O)N(C3CCCCC3)C4CCCCC4

InChI

InChI=1S/C22H31N5O3/c1-2-19-18(13-23-22-24-15-25-27(19)22)21(29)30-14-20(28)26(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h13,15-17H,2-12,14H2,1H3