5-methyl-2-(thiophen-2-ylmethylamino)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 5-methyl-2-(thiophen-2-ylmethylamino)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Openeye Name: 5-methyl-2-(2-thienylmethylamino)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one CAS Name: 5-methyl-2-(thiophen-2-ylmethylamino)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one IUPAC Name: 5-methyl-2-(thiophen-2-ylmethylamino)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Traditional Name: 5-methyl-2-(2-thenylamino)-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Formula: C11H11N5OS MolecularWeight: 261.30294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N2C(=N1)N=C(N2)NCC3=CC=CS3

Isomeric SMILES

CC1=CC(=O)N2C(=N1)N=C(N2)NCC3=CC=CS3

InChI

InChI=1S/C11H11N5OS/c1-7-5-9(17)16-11(13-7)14-10(15-16)12-6-8-3-2-4-18-8/h2-5H,6H2,1H3,(H2,12,13,14,15)