1,1-bis(oxidanylidene)-7-propan-2-yl-2-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-4H-1$l^{6},2,4-benzothiadiazin-3-one

Systemtic Name: 1,1-bis(oxidanylidene)-7-propan-2-yl-2-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-4H-1$l^{6},2,4-benzothiadiazin-3-one Openeye Name: 7-isopropyl-1,1-dioxo-2-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-4H-1$l^{6},2,4-benzothiadiazin-3-one CAS Name: 1,1-dioxo-7-propan-2-yl-2-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-4H-1$l^{6},2,4-benzothiadiazin-3-one IUPAC Name: 1,1-dioxo-7-propan-2-yl-2-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-4H-1$l^{6},2,4-benzothiadiazin-3-one Traditional Name: 7-isopropyl-1,1-diketo-2-[3-[4-(2-pyrimidyl)piperazino]propyl]-4H-1$l^{6},2,4-benzothiadiazin-3-one Formula: C21H28N6O3S MolecularWeight: 444.55042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)NC(=O)N(S2(=O)=O)CCCN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)NC(=O)N(S2(=O)=O)CCCN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H28N6O3S/c1-16(2)17-5-6-18-19(15-17)31(29,30)27(21(28)24-18)10-4-9-25-11-13-26(14-12-25)20-22-7-3-8-23-20/h3,5-8,15-16H,4,9-14H2,1-2H3,(H,24,28)