[(Z)-cyano-(4-oxidanylidene-1H-quinazolin-2-ylidene)methyl] carbamimidothioate

Systemtic Name: [(Z)-cyano-(4-oxidanylidene-1H-quinazolin-2-ylidene)methyl] carbamimidothioate Openeye Name: 2-[(Z)-cyano-(4-oxo-1H-quinazolin-2-ylidene)methyl]isothiourea CAS Name: carbamimidothioic acid [(Z)-cyano-(4-oxo-1H-quinazolin-2-ylidene)methyl] ester IUPAC Name: [(Z)-cyano-(4-oxo-1H-quinazolin-2-ylidene)methyl] carbamimidothioate Traditional Name: 2-[(Z)-cyano-(4-keto-1H-quinazolin-2-ylidene)methyl]isothiourea Formula: C11H9N5OS MolecularWeight: 259.28706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC(=C(C#N)SC(=N)N)N2

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N/C(=C(/C#N)\SC(=N)N)/N2

InChI

InChI=1S/C11H9N5OS/c12-5-8(18-11(13)14)9-15-7-4-2-1-3-6(7)10(17)16-9/h1-4,15H,(H3,13,14)(H,16,17)/b9-8-