5-[[3-[4-(2-methoxyphenyl)piperazin-1-yl]piperidin-1-yl]methyl]-2,1,3-benzothiadiazole

Systemtic Name: 5-[[3-[4-(2-methoxyphenyl)piperazin-1-yl]piperidin-1-yl]methyl]-2,1,3-benzothiadiazole Openeye Name: 5-[[3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-piperidyl]methyl]-2,1,3-benzothiadiazole CAS Name: 5-[[3-[4-(2-methoxyphenyl)-1-piperazinyl]-1-piperidinyl]methyl]-2,1,3-benzothiadiazole IUPAC Name: 5-[[3-[4-(2-methoxyphenyl)piperazin-1-yl]piperidin-1-yl]methyl]-2,1,3-benzothiadiazole Traditional Name: 5-[[3-[4-(2-methoxyphenyl)piperazino]piperidino]methyl]piazthiole Formula: C23H29N5OS MolecularWeight: 423.57426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3CCCN(C3)CC4=CC5=NSN=C5C=C4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3CCCN(C3)CC4=CC5=NSN=C5C=C4

InChI

InChI=1S/C23H29N5OS/c1-29-23-7-3-2-6-22(23)28-13-11-27(12-14-28)19-5-4-10-26(17-19)16-18-8-9-20-21(15-18)25-30-24-20/h2-3,6-9,15,19H,4-5,10-14,16-17H2,1H3