(3S)-1-(3,4-dimethoxyphenyl)sulfonyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidin-3-amine

Systemtic Name: (3S)-1-(3,4-dimethoxyphenyl)sulfonyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidin-3-amine Openeye Name: (3S)-1-(3,4-dimethoxyphenyl)sulfonyl-N-ethyl-N-(4-pyridylmethyl)piperidin-3-amine CAS Name: (3S)-1-(3,4-dimethoxyphenyl)sulfonyl-N-ethyl-N-(pyridin-4-ylmethyl)-3-piperidinamine IUPAC Name: (3S)-1-(3,4-dimethoxyphenyl)sulfonyl-N-ethyl-N-(pyridin-4-ylmethyl)piperidin-3-amine Traditional Name: [(3S)-1-(3,4-dimethoxyphenyl)sulfonyl-3-piperidyl]-ethyl-(4-pyridylmethyl)amine Formula: C21H29N3O4S MolecularWeight: 419.53766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)C2CCCN(C2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCN(CC1=CC=NC=C1)[C@H]2CCCN(C2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H29N3O4S/c1-4-23(15-17-9-11-22-12-10-17)18-6-5-13-24(16-18)29(25,26)19-7-8-20(27-2)21(14-19)28-3/h7-12,14,18H,4-6,13,15-16H2,1-3H3/t18-/m0/s1