(9-oxidanylidenexanthen-4-yl)methyl carbamimidothioate

Systemtic Name: (9-oxidanylidenexanthen-4-yl)methyl carbamimidothioate Openeye Name: 2-[(9-oxoxanthen-4-yl)methyl]isothiourea CAS Name: carbamimidothioic acid (9-oxo-4-xanthenyl)methyl ester IUPAC Name: (9-oxoxanthen-4-yl)methyl carbamimidothioate Traditional Name: 2-[(9-ketoxanthen-4-yl)methyl]isothiourea Formula: C15H12N2O2S MolecularWeight: 284.33298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(O2)C(=CC=C3)CSC(=N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(O2)C(=CC=C3)CSC(=N)N

InChI

InChI=1S/C15H12N2O2S/c16-15(17)20-8-9-4-3-6-11-13(18)10-5-1-2-7-12(10)19-14(9)11/h1-7H,8H2,(H3,16,17)