methyl 5-([1,2,4]triazolo[1,5-c]quinazolin-2-ylsulfanyl)pentanoate

Systemtic Name: methyl 5-([1,2,4]triazolo[1,5-c]quinazolin-2-ylsulfanyl)pentanoate Openeye Name: methyl 5-([1,2,4]triazolo[1,5-c]quinazolin-2-ylsulfanyl)pentanoate CAS Name: 5-([1,2,4]triazolo[1,5-c]quinazolin-2-ylthio)pentanoic acid methyl ester IUPAC Name: methyl 5-([1,2,4]triazolo[1,5-c]quinazolin-2-ylsulfanyl)pentanoate Traditional Name: 5-([1,2,4]triazolo[1,5-c]quinazolin-2-ylthio)valeric acid methyl ester Formula: C15H16N4O2S MolecularWeight: 316.37814

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCSC1=NN2C=NC3=CC=CC=C3C2=N1

Isomeric SMILES

COC(=O)CCCCSC1=NN2C=NC3=CC=CC=C3C2=N1

InChI

InChI=1S/C15H16N4O2S/c1-21-13(20)8-4-5-9-22-15-17-14-11-6-2-3-7-12(11)16-10-19(14)18-15/h2-3,6-7,10H,4-5,8-9H2,1H3