(1-oxidanylidene-8aH-quinolin-1-ium-4-yl) carbamimidothioate

Systemtic Name: (1-oxidanylidene-8aH-quinolin-1-ium-4-yl) carbamimidothioate Openeye Name: 2-(1-oxo-8aH-quinolin-1-ium-4-yl)isothiourea CAS Name: carbamimidothioic acid (1-oxo-8aH-quinolin-1-ium-4-yl) ester IUPAC Name: (1-oxo-8aH-quinolin-1-ium-4-yl) carbamimidothioate Traditional Name: 2-(1-keto-8aH-quinolin-1-ium-4-yl)isothiourea Formula: C10H10N3OS+ MolecularWeight: 220.2709

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2C(=C(C=C[N+]2=O)SC(=N)N)C=C1

Isomeric SMILES

C1=CC2C(=C(C=C[N+]2=O)SC(=N)N)C=C1

InChI

InChI=1S/C10H10N3OS/c11-10(12)15-9-5-6-13(14)8-4-2-1-3-7(8)9/h1-6,8H,(H3,11,12)/q+1