4-methyl-1,1-bis(oxidanylidene)-5-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1$l^{6},2,4-benzothiadiazin-3-one

Systemtic Name: 4-methyl-1,1-bis(oxidanylidene)-5-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1$l^{6},2,4-benzothiadiazin-3-one Openeye Name: 4-methyl-1,1-dioxo-5-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1$l^{6},2,4-benzothiadiazin-3-one CAS Name: 4-methyl-1,1-dioxo-5-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-1$l^{6},2,4-benzothiadiazin-3-one IUPAC Name: 4-methyl-1,1-dioxo-5-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1$l^{6},2,4-benzothiadiazin-3-one Traditional Name: 1,1-diketo-4-methyl-5-[4-[4-(2-pyrimidyl)piperazino]butyl]-1$l^{6},2,4-benzothiadiazin-3-one Formula: C20H26N6O3S MolecularWeight: 430.52384

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC=C2S(=O)(=O)NC1=O)CCCCN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CN1C2=C(C=CC=C2S(=O)(=O)NC1=O)CCCCN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H26N6O3S/c1-24-18-16(7-4-8-17(18)30(28,29)23-20(24)27)6-2-3-11-25-12-14-26(15-13-25)19-21-9-5-10-22-19/h4-5,7-10H,2-3,6,11-15H2,1H3,(H,23,27)