(2S)-N-(4-ethylsulfonylphenyl)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide

Systemtic Name: (2S)-N-(4-ethylsulfonylphenyl)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Openeye Name: (2S)-N-(4-ethylsulfonylphenyl)-3-methyl-2-[[(E)-styryl]sulfonylamino]butanamide CAS Name: (2S)-N-(4-ethylsulfonylphenyl)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide IUPAC Name: (2S)-N-(4-ethylsulfonylphenyl)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Traditional Name: (2S)-N-(4-esylphenyl)-3-methyl-2-[[(E)-styryl]sulfonylamino]butyramide Formula: C21H26N2O5S2 MolecularWeight: 450.57154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)C(C(C)C)NS(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)[C@H](C(C)C)NS(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C21H26N2O5S2/c1-4-29(25,26)19-12-10-18(11-13-19)22-21(24)20(16(2)3)23-30(27,28)15-14-17-8-6-5-7-9-17/h5-16,20,23H,4H2,1-3H3,(H,22,24)/b15-14+/t20-/m0/s1