[1,3-bis(oxidanylidene)isoindol-2-yl]methyl carbamimidothioate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl carbamimidothioate Openeye Name: 2-[(1,3-dioxoisoindolin-2-yl)methyl]isothiourea CAS Name: carbamimidothioic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl carbamimidothioate Traditional Name: 2-(phthalimidomethyl)isothiourea Formula: C10H9N3O2S MolecularWeight: 235.26236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CSC(=N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CSC(=N)N

InChI

InChI=1S/C10H9N3O2S/c11-10(12)16-5-13-8(14)6-3-1-2-4-7(6)9(13)15/h1-4H,5H2,(H3,11,12)