N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide Openeye Name: N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: N-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]-4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyramide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCNC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCNC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C23H31N3O5S2/c1-17-9-10-18(2)21(15-17)33(29,30)25-13-12-24-23(28)20(11-14-32-3)26-22(27)16-31-19-7-5-4-6-8-19/h4-10,15,20,25H,11-14,16H2,1-3H3,(H,24,28)(H,26,27)