N-[[4-(dimethylaminomethyl)phenyl]methyl]-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanamide

Systemtic Name: N-[[4-(dimethylaminomethyl)phenyl]methyl]-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanamide Openeye Name: N-[[4-(dimethylaminomethyl)phenyl]methyl]-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanamide CAS Name: N-[[4-(dimethylaminomethyl)phenyl]methyl]-4-[(4-fluorophenyl)sulfonyl-methylamino]butanamide IUPAC Name: N-[[4-(dimethylaminomethyl)phenyl]methyl]-4-[(4-fluorophenyl)sulfonyl-methylamino]butanamide Traditional Name: N-[4-(dimethylaminomethyl)benzyl]-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butyramide Formula: C21H28FN3O3S MolecularWeight: 421.528723

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(C=C1)CNC(=O)CCCN(C)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CN(C)CC1=CC=C(C=C1)CNC(=O)CCCN(C)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C21H28FN3O3S/c1-24(2)16-18-8-6-17(7-9-18)15-23-21(26)5-4-14-25(3)29(27,28)20-12-10-19(22)11-13-20/h6-13H,4-5,14-16H2,1-3H3,(H,23,26)