S-[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl] 4-azidobenzenecarbothioate

Systemtic Name: S-[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl] 4-azidobenzenecarbothioate Openeye Name: S-(2,4-dioxo-1H-pyrimidin-5-yl) 4-azidobenzenecarbothioate CAS Name: 4-azidobenzenecarbothioic acid S-(2,4-dioxo-1H-pyrimidin-5-yl) ester IUPAC Name: S-(2,4-dioxo-1H-pyrimidin-5-yl) 4-azidobenzenecarbothioate Traditional Name: 4-azidothiobenzoic acid S-(2,4-diketo-1H-pyrimidin-5-yl) ester Formula: C11H7N5O3S MolecularWeight: 289.26998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)SC2=CNC(=O)NC2=O)N=[N+]=[N-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)SC2=CNC(=O)NC2=O)N=[N+]=[N-]

InChI

InChI=1S/C11H7N5O3S/c12-16-15-7-3-1-6(2-4-7)10(18)20-8-5-13-11(19)14-9(8)17/h1-5H,(H2,13,14,17,19)