3-[2-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[2-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[2-[(3R)-3,5-bis(2-thienyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[2-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[2-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]-2-oxoethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[2-[(5R)-3,5-bis(2-thienyl)-2-pyrazolin-1-yl]-2-keto-ethyl]-1,2,3-benzotriazin-4-one Formula: C20H15N5O2S2 MolecularWeight: 421.4954

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CS2)C(=O)CN3C(=O)C4=CC=CC=C4N=N3)C5=CC=CS5

Isomeric SMILES

C1[C@@H](N(N=C1C2=CC=CS2)C(=O)CN3C(=O)C4=CC=CC=C4N=N3)C5=CC=CS5

InChI

InChI=1S/C20H15N5O2S2/c26-19(12-24-20(27)13-5-1-2-6-14(13)21-23-24)25-16(18-8-4-10-29-18)11-15(22-25)17-7-3-9-28-17/h1-10,16H,11-12H2/t16-/m1/s1