2,1,3-benzothiadiazol-5-yl-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: 2,1,3-benzothiadiazol-5-yl-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: 2,1,3-benzothiadiazol-5-yl-[4-[6-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: 2,1,3-benzothiadiazol-5-yl-[4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: 2,1,3-benzothiadiazol-5-yl-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: piazthiol-5-yl-[4-(6-piperidinopyrimidin-4-yl)piperazino]methanone Formula: C20H23N7OS MolecularWeight: 409.50792

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)C4=CC5=NSN=C5C=C4

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)C4=CC5=NSN=C5C=C4

InChI

InChI=1S/C20H23N7OS/c28-20(15-4-5-16-17(12-15)24-29-23-16)27-10-8-26(9-11-27)19-13-18(21-14-22-19)25-6-2-1-3-7-25/h4-5,12-14H,1-3,6-11H2