octyl 5-methyl-7-thiophen-2-yl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: octyl 5-methyl-7-thiophen-2-yl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: octyl 5-methyl-7-(2-thienyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 5-methyl-7-thiophen-2-yl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid octyl ester IUPAC Name: octyl 5-methyl-7-thiophen-2-yl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 5-methyl-7-(2-thienyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid octyl ester Formula: C19H26N4O2S MolecularWeight: 374.50034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=C(N=C2N=CNN2C1C3=CC=CS3)C

Isomeric SMILES

CCCCCCCCOC(=O)C1=C(N=C2N=CNN2C1C3=CC=CS3)C

InChI

InChI=1S/C19H26N4O2S/c1-3-4-5-6-7-8-11-25-18(24)16-14(2)22-19-20-13-21-23(19)17(16)15-10-9-12-26-15/h9-10,12-13,17H,3-8,11H2,1-2H3,(H,20,21,22)