6-azanyl-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-amino-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylthio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methylthio]-1H-pyrimidin-4-one Formula: C13H12N6OS2 MolecularWeight: 332.40398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NNC2=S)CSC3=NC(=O)C=C(N3)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NNC2=S)CSC3=NC(=O)C=C(N3)N

InChI

InChI=1S/C13H12N6OS2/c14-9-6-11(20)16-12(15-9)22-7-10-17-18-13(21)19(10)8-4-2-1-3-5-8/h1-6H,7H2,(H,18,21)(H3,14,15,16,20)