2-azanyl-8-nitro-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one

Systemtic Name: 2-azanyl-8-nitro-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 2-amino-8-nitro-1H-benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 2-amino-8-nitro-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 2-amino-8-nitro-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 2-amino-8-nitro-1H-benzothiopheno[3,2-d]pyrimidin-4-one Formula: C10H6N4O3S MolecularWeight: 262.24464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C3=C(S2)C(=O)N=C(N3)N

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C3=C(S2)C(=O)N=C(N3)N

InChI

InChI=1S/C10H6N4O3S/c11-10-12-7-5-3-4(14(16)17)1-2-6(5)18-8(7)9(15)13-10/h1-3H,(H3,11,12,13,15)