propan-2-yl 3-[3-[(2,5-dimethylphenyl)sulfonylamino]propanoylamino]-3-phenyl-propanoate

Systemtic Name: propan-2-yl 3-[3-[(2,5-dimethylphenyl)sulfonylamino]propanoylamino]-3-phenyl-propanoate Openeye Name: isopropyl 3-[3-[(2,5-dimethylphenyl)sulfonylamino]propanoylamino]-3-phenyl-propanoate CAS Name: 3-[[3-[(2,5-dimethylphenyl)sulfonylamino]-1-oxopropyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[3-[(2,5-dimethylphenyl)sulfonylamino]propanoylamino]-3-phenylpropanoate Traditional Name: 3-[3-[(2,5-dimethylphenyl)sulfonylamino]propanoylamino]-3-phenyl-propionic acid isopropyl ester Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)NC(CC(=O)OC(C)C)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)NC(CC(=O)OC(C)C)C2=CC=CC=C2

InChI

InChI=1S/C23H30N2O5S/c1-16(2)30-23(27)15-20(19-8-6-5-7-9-19)25-22(26)12-13-24-31(28,29)21-14-17(3)10-11-18(21)4/h5-11,14,16,20,24H,12-13,15H2,1-4H3,(H,25,26)