(6-chloranyl-3-oxidanylidene-4-phenyl-pyrazin-2-yl) carbamimidothioate

Systemtic Name: (6-chloranyl-3-oxidanylidene-4-phenyl-pyrazin-2-yl) carbamimidothioate Openeye Name: 2-(6-chloro-3-oxo-4-phenyl-pyrazin-2-yl)isothiourea CAS Name: carbamimidothioic acid (6-chloro-3-oxo-4-phenyl-2-pyrazinyl) ester IUPAC Name: (6-chloro-3-oxo-4-phenylpyrazin-2-yl) carbamimidothioate Traditional Name: 2-(6-chloro-3-keto-4-phenyl-pyrazin-2-yl)isothiourea Formula: C11H9ClN4OS MolecularWeight: 280.73336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(N=C(C2=O)SC(=N)N)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(N=C(C2=O)SC(=N)N)Cl

InChI

InChI=1S/C11H9ClN4OS/c12-8-6-16(7-4-2-1-3-5-7)10(17)9(15-8)18-11(13)14/h1-6H,(H3,13,14)