5-(octylamino)-3H-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-one

Systemtic Name: 5-(octylamino)-3H-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-one Openeye Name: 5-(octylamino)-3H-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-one CAS Name: 5-(octylamino)-3H-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-one IUPAC Name: 5-(octylamino)-3H-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-one Traditional Name: 5-(octylamino)-3H-[1,2,5]thiadiazolo[3,4-d]pyrimidin-7-one Formula: C12H19N5OS MolecularWeight: 281.37716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=NC(=O)C2=NSNC2=N1

Isomeric SMILES

CCCCCCCCNC1=NC(=O)C2=NSNC2=N1

InChI

InChI=1S/C12H19N5OS/c1-2-3-4-5-6-7-8-13-12-14-10-9(11(18)15-12)16-19-17-10/h2-8H2,1H3,(H2,13,14,15,17,18)