3-(4-bromophenyl)-6-(4-piperidin-1-ylbutoxy)-1,2-benzothiazole

Systemtic Name: 3-(4-bromophenyl)-6-(4-piperidin-1-ylbutoxy)-1,2-benzothiazole Openeye Name: 3-(4-bromophenyl)-6-[4-(1-piperidyl)butoxy]-1,2-benzothiazole CAS Name: 3-(4-bromophenyl)-6-[4-(1-piperidinyl)butoxy]-1,2-benzothiazole IUPAC Name: 3-(4-bromophenyl)-6-(4-piperidin-1-ylbutoxy)-1,2-benzothiazole Traditional Name: 3-(4-bromophenyl)-6-(4-piperidinobutoxy)-1,2-benzothiazole Formula: C22H25BrN2OS MolecularWeight: 445.4157

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCOC2=CC3=C(C=C2)C(=NS3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CCN(CC1)CCCCOC2=CC3=C(C=C2)C(=NS3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H25BrN2OS/c23-18-8-6-17(7-9-18)22-20-11-10-19(16-21(20)27-24-22)26-15-5-4-14-25-12-2-1-3-13-25/h6-11,16H,1-5,12-15H2