N-[1-[(3R)-3-(3-cyanophenyl)-3-(4-methylsulfonylphenyl)propyl]piperidin-4-yl]-N-ethyl-2-(4-methylsulfonylphenyl)ethanamide

Systemtic Name: N-[1-[(3R)-3-(3-cyanophenyl)-3-(4-methylsulfonylphenyl)propyl]piperidin-4-yl]-N-ethyl-2-(4-methylsulfonylphenyl)ethanamide Openeye Name: N-[1-[(3R)-3-(3-cyanophenyl)-3-(4-methylsulfonylphenyl)propyl]-4-piperidyl]-N-ethyl-2-(4-methylsulfonylphenyl)acetamide CAS Name: N-[1-[(3R)-3-(3-cyanophenyl)-3-(4-methylsulfonylphenyl)propyl]-4-piperidinyl]-N-ethyl-2-(4-methylsulfonylphenyl)acetamide IUPAC Name: N-[1-[(3R)-3-(3-cyanophenyl)-3-(4-methylsulfonylphenyl)propyl]piperidin-4-yl]-N-ethyl-2-(4-methylsulfonylphenyl)acetamide Traditional Name: N-[1-[(3R)-3-(3-cyanophenyl)-3-(4-mesylphenyl)propyl]-4-piperidyl]-N-ethyl-2-(4-mesylphenyl)acetamide Formula: C33H39N3O5S2 MolecularWeight: 621.80986

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(CC1)CCC(C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC(=C3)C#N)C(=O)CC4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CCN(C1CCN(CC1)CC[C@H](C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC(=C3)C#N)C(=O)CC4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C33H39N3O5S2/c1-4-36(33(37)23-25-8-12-30(13-9-25)42(2,38)39)29-16-19-35(20-17-29)21-18-32(28-7-5-6-26(22-28)24-34)27-10-14-31(15-11-27)43(3,40)41/h5-15,22,29,32H,4,16-21,23H2,1-3H3/t32-/m1/s1