5-azanyl-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)methyl]-4H-pyrazol-3-one

Systemtic Name: 5-azanyl-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)methyl]-4H-pyrazol-3-one Openeye Name: 5-amino-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)methyl]-4H-pyrazol-3-one CAS Name: 5-amino-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)methyl]-4H-pyrazol-3-one IUPAC Name: 5-amino-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)methyl]-4H-pyrazol-3-one Traditional Name: 5-amino-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)methyl]-2-pyrazolin-3-one Formula: C12H11N5OS MolecularWeight: 273.31364

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)CC2=NN=C(S2)C3=CC=CC=C3)N

Isomeric SMILES

C1C(=NN(C1=O)CC2=NN=C(S2)C3=CC=CC=C3)N

InChI

InChI=1S/C12H11N5OS/c13-9-6-11(18)17(16-9)7-10-14-15-12(19-10)8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,13,16)