4-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]chromen-2-one

Systemtic Name: 4-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]chromen-2-one Openeye Name: 4-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]chromen-2-one CAS Name: 4-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-benzopyran-2-one IUPAC Name: 4-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]chromen-2-one Traditional Name: 4-[(5-amino-1H-1,2,4-triazol-3-yl)thio]coumarin Formula: C11H8N4O2S MolecularWeight: 260.27182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=O)O2)SC3=NNC(=N3)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=O)O2)SC3=NNC(=N3)N

InChI

InChI=1S/C11H8N4O2S/c12-10-13-11(15-14-10)18-8-5-9(16)17-7-4-2-1-3-6(7)8/h1-5H,(H3,12,13,14,15)