N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-3-(4-fluorophenyl)sulfonyl-propanamide

Systemtic Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-3-(4-fluorophenyl)sulfonyl-propanamide Openeye Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-3-(4-fluorophenyl)sulfonyl-propanamide CAS Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-3-(4-fluorophenyl)sulfonylpropanamide IUPAC Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-3-(4-fluorophenyl)sulfonylpropanamide Traditional Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-3-(4-fluorophenyl)sulfonyl-propionamide Formula: C21H26FNO5S MolecularWeight: 423.498243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](C)NC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F)OCC

InChI

InChI=1S/C21H26FNO5S/c1-4-27-19-11-6-16(14-20(19)28-5-2)15(3)23-21(24)12-13-29(25,26)18-9-7-17(22)8-10-18/h6-11,14-15H,4-5,12-13H2,1-3H3,(H,23,24)/t15-/m0/s1