N-ethyl-N-[(3-fluorophenyl)methyl]-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide

Systemtic Name: N-ethyl-N-[(3-fluorophenyl)methyl]-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Openeye Name: N-ethyl-N-[(3-fluorophenyl)methyl]-4-methylsulfanyl-2-[[(E)-styryl]sulfonylamino]butanamide CAS Name: N-ethyl-N-[(3-fluorophenyl)methyl]-4-(methylthio)-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide IUPAC Name: N-ethyl-N-[(3-fluorophenyl)methyl]-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Traditional Name: N-ethyl-N-(3-fluorobenzyl)-4-(methylthio)-2-[[(E)-styryl]sulfonylamino]butyramide Formula: C22H27FN2O3S2 MolecularWeight: 450.589783

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=CC=C1)F)C(=O)C(CCSC)NS(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCN(CC1=CC(=CC=C1)F)C(=O)C(CCSC)NS(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C22H27FN2O3S2/c1-3-25(17-19-10-7-11-20(23)16-19)22(26)21(12-14-29-2)24-30(27,28)15-13-18-8-5-4-6-9-18/h4-11,13,15-16,21,24H,3,12,14,17H2,1-2H3/b15-13+