5-azanyl-3-(4-nitrophenyl)-4H-[1,3]thiazolo[4,5-d]pyrimidine-2,7-dione

Systemtic Name: 5-azanyl-3-(4-nitrophenyl)-4H-[1,3]thiazolo[4,5-d]pyrimidine-2,7-dione Openeye Name: 5-amino-3-(4-nitrophenyl)-4H-thiazolo[4,5-d]pyrimidine-2,7-dione CAS Name: 5-amino-3-(4-nitrophenyl)-4H-thiazolo[4,5-d]pyrimidine-2,7-dione IUPAC Name: 5-amino-3-(4-nitrophenyl)-4H-[1,3]thiazolo[4,5-d]pyrimidine-2,7-dione Traditional Name: 5-amino-3-(4-nitrophenyl)-4H-thiazolo[4,5-d]pyrimidine-2,7-quinone Formula: C11H7N5O4S MolecularWeight: 305.26938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C3=C(C(=O)N=C(N3)N)SC2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N2C3=C(C(=O)N=C(N3)N)SC2=O)[N+](=O)[O-]

InChI

InChI=1S/C11H7N5O4S/c12-10-13-8-7(9(17)14-10)21-11(18)15(8)5-1-3-6(4-2-5)16(19)20/h1-4H,(H3,12,13,14,17)