N-[[4-(diethylaminomethyl)phenyl]methyl]-3-(4-fluorophenyl)sulfonyl-propanamide

Systemtic Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-3-(4-fluorophenyl)sulfonyl-propanamide Openeye Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-3-(4-fluorophenyl)sulfonyl-propanamide CAS Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-3-(4-fluorophenyl)sulfonylpropanamide IUPAC Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-3-(4-fluorophenyl)sulfonylpropanamide Traditional Name: N-[4-(diethylaminomethyl)benzyl]-3-(4-fluorophenyl)sulfonyl-propionamide Formula: C21H27FN2O3S MolecularWeight: 406.514083

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)CNC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)CNC(=O)CCS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C21H27FN2O3S/c1-3-24(4-2)16-18-7-5-17(6-8-18)15-23-21(25)13-14-28(26,27)20-11-9-19(22)10-12-20/h5-12H,3-4,13-16H2,1-2H3,(H,23,25)