3-[[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]methyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]methyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[(2S)-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinyl]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(2S)-1-(2-thenoyl)pyrrolidin-2-yl]methyl]-1,2,3-benzotriazin-4-one Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=CS2)CN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC=CS2)CN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C17H16N4O2S/c22-16-13-6-1-2-7-14(13)18-19-21(16)11-12-5-3-9-20(12)17(23)15-8-4-10-24-15/h1-2,4,6-8,10,12H,3,5,9,11H2/t12-/m0/s1