3-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[(4-p-phenetylsulfonylpiperazino)methyl]-1,2,3-benzotriazin-4-one Formula: C20H23N5O4S MolecularWeight: 429.49272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H23N5O4S/c1-2-29-16-7-9-17(10-8-16)30(27,28)24-13-11-23(12-14-24)15-25-20(26)18-5-3-4-6-19(18)21-22-25/h3-10H,2,11-15H2,1H3