N-[[1-[2-(2,6-dimethoxyphenoxy)ethyl]piperidin-4-yl]methyl]-1,3-benzothiazol-2-amine

Systemtic Name: N-[[1-[2-(2,6-dimethoxyphenoxy)ethyl]piperidin-4-yl]methyl]-1,3-benzothiazol-2-amine Openeye Name: N-[[1-[2-(2,6-dimethoxyphenoxy)ethyl]-4-piperidyl]methyl]-1,3-benzothiazol-2-amine CAS Name: N-[[1-[2-(2,6-dimethoxyphenoxy)ethyl]-4-piperidinyl]methyl]-1,3-benzothiazol-2-amine IUPAC Name: N-[[1-[2-(2,6-dimethoxyphenoxy)ethyl]piperidin-4-yl]methyl]-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-[[1-[2-(2,6-dimethoxyphenoxy)ethyl]-4-piperidyl]methyl]amine Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)OCCN2CCC(CC2)CNC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=C(C(=CC=C1)OC)OCCN2CCC(CC2)CNC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H29N3O3S/c1-27-19-7-5-8-20(28-2)22(19)29-15-14-26-12-10-17(11-13-26)16-24-23-25-18-6-3-4-9-21(18)30-23/h3-9,17H,10-16H2,1-2H3,(H,24,25)