5-(5-fluoranyl-3-oxidanidyl-1-prop-2-ynyl-4,5,6,7-tetrahydrobenzotriazol-2-yl)-3H-1,3-benzothiazol-2-one

Systemtic Name: 5-(5-fluoranyl-3-oxidanidyl-1-prop-2-ynyl-4,5,6,7-tetrahydrobenzotriazol-2-yl)-3H-1,3-benzothiazol-2-one Openeye Name: 5-(5-fluoro-3-oxido-1-prop-2-ynyl-4,5,6,7-tetrahydrobenzotriazol-2-yl)-3H-1,3-benzothiazol-2-one CAS Name: 5-(5-fluoro-3-oxido-1-prop-2-ynyl-4,5,6,7-tetrahydrobenzotriazol-2-yl)-3H-1,3-benzothiazol-2-one IUPAC Name: 5-(5-fluoro-3-oxido-1-prop-2-ynyl-4,5,6,7-tetrahydrobenzotriazol-2-yl)-3H-1,3-benzothiazol-2-one Traditional Name: 5-(5-fluoro-3-oxido-1-propargyl-4,5,6,7-tetrahydrobenzotriazol-2-yl)-3H-1,3-benzothiazol-2-one Formula: C16H14FN4O2S- MolecularWeight: 345.371363

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=C(CC(CC2)F)N(N1C3=CC4=C(C=C3)SC(=O)N4)[O-]

Isomeric SMILES

C#CCN1C2=C(CC(CC2)F)N(N1C3=CC4=C(C=C3)SC(=O)N4)[O-]

InChI

InChI=1S/C16H14FN4O2S/c1-2-7-19-13-5-3-10(17)8-14(13)21(23)20(19)11-4-6-15-12(9-11)18-16(22)24-15/h1,4,6,9-10H,3,5,7-8H2,(H,18,22)/q-1