2-[6-[4-(2-methoxyphenyl)piperazin-1-yl]hexylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[6-[4-(2-methoxyphenyl)piperazin-1-yl]hexylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[6-[4-(2-methoxyphenyl)piperazin-1-yl]hexylsulfanyl]-1,3-benzothiazole CAS Name: 2-[6-[4-(2-methoxyphenyl)-1-piperazinyl]hexylthio]-1,3-benzothiazole IUPAC Name: 2-[6-[4-(2-methoxyphenyl)piperazin-1-yl]hexylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[6-[4-(2-methoxyphenyl)piperazino]hexylthio]-1,3-benzothiazole Formula: C24H31N3OS2 MolecularWeight: 441.65244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCCCCSC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCCCCSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H31N3OS2/c1-28-22-12-6-5-11-21(22)27-17-15-26(16-18-27)14-8-2-3-9-19-29-24-25-20-10-4-7-13-23(20)30-24/h4-7,10-13H,2-3,8-9,14-19H2,1H3