3-[[4-(phenylmethyl)sulfonylphenyl]methyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[[4-(phenylmethyl)sulfonylphenyl]methyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(4-benzylsulfonylphenyl)methyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[4-(phenylmethyl)sulfonylphenyl]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(4-benzylsulfonylphenyl)methyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-(4-benzylsulfonylbenzyl)-1,2,3-benzotriazin-4-one Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H17N3O3S/c25-21-19-8-4-5-9-20(19)22-23-24(21)14-16-10-12-18(13-11-16)28(26,27)15-17-6-2-1-3-7-17/h1-13H,14-15H2