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

Systemtic Name: (3S)-N-ethyl-1-(4-methylsulfonylphenyl)sulfonyl-N-(pyridin-4-ylmethyl)piperidin-3-amine Openeye Name: (3S)-N-ethyl-1-(4-methylsulfonylphenyl)sulfonyl-N-(4-pyridylmethyl)piperidin-3-amine CAS Name: (3S)-N-ethyl-1-(4-methylsulfonylphenyl)sulfonyl-N-(pyridin-4-ylmethyl)-3-piperidinamine IUPAC Name: (3S)-N-ethyl-1-(4-methylsulfonylphenyl)sulfonyl-N-(pyridin-4-ylmethyl)piperidin-3-amine Traditional Name: ethyl-[(3S)-1-(4-mesylphenyl)sulfonyl-3-piperidyl]-(4-pyridylmethyl)amine Formula: C20H27N3O4S2 MolecularWeight: 437.57608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N3O4S2/c1-3-22(15-17-10-12-21-13-11-17)18-5-4-14-23(16-18)29(26,27)20-8-6-19(7-9-20)28(2,24)25/h6-13,18H,3-5,14-16H2,1-2H3/t18-/m0/s1