6-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-2H-1,2,4-triazine-3,5-dione

Systemtic Name: 6-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-2H-1,2,4-triazine-3,5-dione Openeye Name: 6-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-2H-1,2,4-triazine-3,5-dione CAS Name: 6-[(4-oxo-1H-quinazolin-2-yl)methylthio]-2H-1,2,4-triazine-3,5-dione IUPAC Name: 6-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-2H-1,2,4-triazine-3,5-dione Traditional Name: 6-[(4-keto-1H-quinazolin-2-yl)methylthio]-2H-1,2,4-triazine-3,5-quinone Formula: C12H9N5O3S MolecularWeight: 303.29656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)CSC3=NNC(=O)NC3=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)CSC3=NNC(=O)NC3=O

InChI

InChI=1S/C12H9N5O3S/c18-9-6-3-1-2-4-7(6)13-8(14-9)5-21-11-10(19)15-12(20)17-16-11/h1-4H,5H2,(H,13,14,18)(H2,15,17,19,20)