(3S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-thiophen-3-ylsulfonyl-piperidin-3-amine

Systemtic Name: (3S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-thiophen-3-ylsulfonyl-piperidin-3-amine Openeye Name: (3S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-(3-thienylsulfonyl)piperidin-3-amine CAS Name: (3S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-(3-thiophenylsulfonyl)-3-piperidinamine IUPAC Name: (3S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-thiophen-3-ylsulfonylpiperidin-3-amine Traditional Name: homoveratryl-methyl-[(3S)-1-(3-thienylsulfonyl)-3-piperidyl]amine Formula: C20H28N2O4S2 MolecularWeight: 424.57732

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C2CCCN(C2)S(=O)(=O)C3=CSC=C3

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)[C@H]2CCCN(C2)S(=O)(=O)C3=CSC=C3

InChI

InChI=1S/C20H28N2O4S2/c1-21(11-8-16-6-7-19(25-2)20(13-16)26-3)17-5-4-10-22(14-17)28(23,24)18-9-12-27-15-18/h6-7,9,12-13,15,17H,4-5,8,10-11,14H2,1-3H3/t17-/m0/s1