N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-[(4-fluorophenyl)sulfonyl-methylamino]butanamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-[(4-fluorophenyl)sulfonyl-methylamino]butanamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butyramide Formula: C20H23FN2O5S MolecularWeight: 422.470423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)CCCN(C)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=O)CCCN(C)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H23FN2O5S/c1-14(15-5-10-18-19(12-15)28-13-27-18)22-20(24)4-3-11-23(2)29(25,26)17-8-6-16(21)7-9-17/h5-10,12,14H,3-4,11,13H2,1-2H3,(H,22,24)