2-(4-chloranyl-3,5-dimethyl-phenoxy)-N-[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl]ethanamide

Systemtic Name: 2-(4-chloranyl-3,5-dimethyl-phenoxy)-N-[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl]ethanamide Openeye Name: 2-(4-chloro-3,5-dimethyl-phenoxy)-N-[(2S)-2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]acetamide CAS Name: 2-(4-chloro-3,5-dimethylphenoxy)-N-[(2S)-2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]acetamide IUPAC Name: 2-(4-chloro-3,5-dimethylphenoxy)-N-[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-ylethyl]acetamide Traditional Name: 2-(4-chloro-3,5-dimethyl-phenoxy)-N-[(2S)-2-pyrrolidino-2-(2-thienyl)ethyl]acetamide Formula: C20H25ClN2O2S MolecularWeight: 392.9427

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCC(=O)NCC(C2=CC=CS2)N3CCCC3

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCC(=O)NC[C@@H](C2=CC=CS2)N3CCCC3

InChI

InChI=1S/C20H25ClN2O2S/c1-14-10-16(11-15(2)20(14)21)25-13-19(24)22-12-17(18-6-5-9-26-18)23-7-3-4-8-23/h5-6,9-11,17H,3-4,7-8,12-13H2,1-2H3,(H,22,24)/t17-/m0/s1