3-[(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[[5-(2-thienyl)-1,2,4-oxadiazol-3-yl]methyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)methyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[5-(2-thienyl)-1,2,4-oxadiazol-3-yl]methyl]-1,2,3-benzotriazin-4-one Formula: C14H9N5O2S MolecularWeight: 311.31856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CC3=NOC(=N3)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CC3=NOC(=N3)C4=CC=CS4

InChI

InChI=1S/C14H9N5O2S/c20-14-9-4-1-2-5-10(9)16-18-19(14)8-12-15-13(21-17-12)11-6-3-7-22-11/h1-7H,8H2