9-(3-azanylpropoxy)-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one

Systemtic Name: 9-(3-azanylpropoxy)-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 9-(3-aminopropoxy)-1H-benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 9-(3-aminopropoxy)-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 9-(3-aminopropoxy)-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 9-(3-aminopropoxy)-1H-benzothiopheno[3,2-d]pyrimidin-4-one Formula: C13H13N3O2S MolecularWeight: 275.32622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)SC3=C2NC=NC3=O)OCCCN

Isomeric SMILES

C1=CC(=C2C(=C1)SC3=C2NC=NC3=O)OCCCN

InChI

InChI=1S/C13H13N3O2S/c14-5-2-6-18-8-3-1-4-9-10(8)11-12(19-9)13(17)16-7-15-11/h1,3-4,7H,2,5-6,14H2,(H,15,16,17)