3-[2-(2H-1,2,3-triazol-4-ylsulfanyl)ethanoyl]chromen-2-one

Systemtic Name: 3-[2-(2H-1,2,3-triazol-4-ylsulfanyl)ethanoyl]chromen-2-one Openeye Name: 3-[2-(2H-triazol-4-ylsulfanyl)acetyl]chromen-2-one CAS Name: 3-[1-oxo-2-(2H-triazol-4-ylthio)ethyl]-1-benzopyran-2-one IUPAC Name: 3-[2-(2H-triazol-4-ylsulfanyl)acetyl]chromen-2-one Traditional Name: 3-[2-(2H-triazol-4-ylthio)acetyl]coumarin Formula: C13H9N3O3S MolecularWeight: 287.29386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)CSC3=NNN=C3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)CSC3=NNN=C3

InChI

InChI=1S/C13H9N3O3S/c17-10(7-20-12-6-14-16-15-12)9-5-8-3-1-2-4-11(8)19-13(9)18/h1-6H,7H2,(H,14,15,16)