methyl 6-[[4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]hexanoate

Systemtic Name: methyl 6-[[4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]hexanoate Openeye Name: methyl 6-[[4-methyl-2-(p-tolylsulfonylamino)pentanoyl]amino]hexanoate CAS Name: 6-[[4-methyl-2-[(4-methylphenyl)sulfonylamino]-1-oxopentyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]hexanoate Traditional Name: 6-[[4-methyl-2-(tosylamino)pentanoyl]amino]hexanoic acid methyl ester Formula: C20H32N2O5S MolecularWeight: 412.54348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)NCCCCCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)NCCCCCC(=O)OC

InChI

InChI=1S/C20H32N2O5S/c1-15(2)14-18(20(24)21-13-7-5-6-8-19(23)27-4)22-28(25,26)17-11-9-16(3)10-12-17/h9-12,15,18,22H,5-8,13-14H2,1-4H3,(H,21,24)