1-(2,1,3-benzothiadiazol-5-ylmethyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-piperidin-3-amine

Systemtic Name: 1-(2,1,3-benzothiadiazol-5-ylmethyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-piperidin-3-amine Openeye Name: 1-(2,1,3-benzothiadiazol-5-ylmethyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-piperidin-3-amine CAS Name: 1-(2,1,3-benzothiadiazol-5-ylmethyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-piperidinamine IUPAC Name: 1-(2,1,3-benzothiadiazol-5-ylmethyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylpiperidin-3-amine Traditional Name: homoveratryl-methyl-[1-(piazthiol-5-ylmethyl)-3-piperidyl]amine Formula: C23H30N4O2S MolecularWeight: 426.5749

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C2CCCN(C2)CC3=CC4=NSN=C4C=C3

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C2CCCN(C2)CC3=CC4=NSN=C4C=C3

InChI

InChI=1S/C23H30N4O2S/c1-26(12-10-17-7-9-22(28-2)23(14-17)29-3)19-5-4-11-27(16-19)15-18-6-8-20-21(13-18)25-30-24-20/h6-9,13-14,19H,4-5,10-12,15-16H2,1-3H3