3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[(4-besylpiperazino)methyl]-1,2,3-benzotriazin-4-one Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=O)C3=CC=CC=C3N=N2)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CN2C(=O)C3=CC=CC=C3N=N2)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C18H19N5O3S/c24-18-16-8-4-5-9-17(16)19-20-23(18)14-21-10-12-22(13-11-21)27(25,26)15-6-2-1-3-7-15/h1-9H,10-14H2