methyl 2-[(4-methylphenyl)sulfonylamino]-6-[(2-methyl-6-propan-2-yl-phenyl)carbamoylamino]hexanoate

Systemtic Name: methyl 2-[(4-methylphenyl)sulfonylamino]-6-[(2-methyl-6-propan-2-yl-phenyl)carbamoylamino]hexanoate Openeye Name: methyl 6-[(2-isopropyl-6-methyl-phenyl)carbamoylamino]-2-(p-tolylsulfonylamino)hexanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]-6-[[(2-methyl-6-propan-2-ylanilino)-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 2-[(4-methylphenyl)sulfonylamino]-6-[(2-methyl-6-propan-2-ylphenyl)carbamoylamino]hexanoate Traditional Name: 6-[(2-isopropyl-6-methyl-phenyl)carbamoylamino]-2-(tosylamino)hexanoic acid methyl ester Formula: C25H35N3O5S MolecularWeight: 489.6275

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCNC(=O)NC2=C(C=CC=C2C(C)C)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCNC(=O)NC2=C(C=CC=C2C(C)C)C)C(=O)OC

InChI

InChI=1S/C25H35N3O5S/c1-17(2)21-10-8-9-19(4)23(21)27-25(30)26-16-7-6-11-22(24(29)33-5)28-34(31,32)20-14-12-18(3)13-15-20/h8-10,12-15,17,22,28H,6-7,11,16H2,1-5H3,(H2,26,27,30)