N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-1,3-benzothiazol-2-amine hydrochloride

Systemtic Name: N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-1,3-benzothiazol-2-amine hydrochloride Openeye Name: N-[3-[3-(1-piperidylmethyl)phenoxy]propyl]-1,3-benzothiazol-2-amine hydrochloride CAS Name: N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]-1,3-benzothiazol-2-amine hydrochloride IUPAC Name: N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-1,3-benzothiazol-2-amine hydrochloride Traditional Name: 1,3-benzothiazol-2-yl-[3-[3-(piperidinomethyl)phenoxy]propyl]amine hydrochloride Formula: C22H28ClN3OS MolecularWeight: 417.99522

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC3=NC4=CC=CC=C4S3.Cl

Isomeric SMILES

C1CCN(CC1)CC2=CC(=CC=C2)OCCCNC3=NC4=CC=CC=C4S3.Cl

InChI

InChI=1S/C22H27N3OS.ClH/c1-4-13-25(14-5-1)17-18-8-6-9-19(16-18)26-15-7-12-23-22-24-20-10-2-3-11-21(20)27-22;/h2-3,6,8-11,16H,1,4-5,7,12-15,17H2,(H,23,24);1H