N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanamide

Systemtic Name: N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanamide Openeye Name: N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanamide CAS Name: N-[1-(4-ethoxy-3-methoxyphenyl)ethyl]-4-[(4-fluorophenyl)sulfonyl-methylamino]butanamide IUPAC Name: N-[1-(4-ethoxy-3-methoxyphenyl)ethyl]-4-[(4-fluorophenyl)sulfonyl-methylamino]butanamide Traditional Name: N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butyramide Formula: C22H29FN2O5S MolecularWeight: 452.539463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NC(=O)CCCN(C)S(=O)(=O)C2=CC=C(C=C2)F)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)NC(=O)CCCN(C)S(=O)(=O)C2=CC=C(C=C2)F)OC

InChI

InChI=1S/C22H29FN2O5S/c1-5-30-20-13-8-17(15-21(20)29-4)16(2)24-22(26)7-6-14-25(3)31(27,28)19-11-9-18(23)10-12-19/h8-13,15-16H,5-7,14H2,1-4H3,(H,24,26)