4-[(5-imidazol-1-yl-2-methyl-phenyl)-[2-[(4-methylphenyl)sulfonylamino]propanoyloxy]methyl]-3,5-dimethyl-benzoate

Systemtic Name: 4-[(5-imidazol-1-yl-2-methyl-phenyl)-[2-[(4-methylphenyl)sulfonylamino]propanoyloxy]methyl]-3,5-dimethyl-benzoate Openeye Name: 4-[(5-imidazol-1-yl-2-methyl-phenyl)-[2-(p-tolylsulfonylamino)propanoyloxy]methyl]-3,5-dimethyl-benzoate CAS Name: 4-[[5-(1-imidazolyl)-2-methylphenyl]-[2-[(4-methylphenyl)sulfonylamino]-1-oxopropoxy]methyl]-3,5-dimethylbenzoate IUPAC Name: 4-[(5-imidazol-1-yl-2-methylphenyl)-[2-[(4-methylphenyl)sulfonylamino]propanoyloxy]methyl]-3,5-dimethylbenzoate Traditional Name: 4-[(5-imidazol-1-yl-2-methyl-phenyl)-[2-(tosylamino)propanoyloxy]methyl]-3,5-dimethyl-benzoate Formula: C30H30N3O6S- MolecularWeight: 560.6407

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OC(C2=C(C=CC(=C2)N3C=CN=C3)C)C4=C(C=C(C=C4C)C(=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OC(C2=C(C=CC(=C2)N3C=CN=C3)C)C4=C(C=C(C=C4C)C(=O)[O-])C

InChI

InChI=1S/C30H31N3O6S/c1-18-6-10-25(11-7-18)40(37,38)32-22(5)30(36)39-28(27-20(3)14-23(29(34)35)15-21(27)4)26-16-24(9-8-19(26)2)33-13-12-31-17-33/h6-17,22,28,32H,1-5H3,(H,34,35)/p-1