methyl 2-[(4-methylphenyl)sulfonylamino]-6-(thiophen-2-ylsulfonylamino)hexanoate

Systemtic Name: methyl 2-[(4-methylphenyl)sulfonylamino]-6-(thiophen-2-ylsulfonylamino)hexanoate Openeye Name: methyl 2-(p-tolylsulfonylamino)-6-(2-thienylsulfonylamino)hexanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]-6-(thiophen-2-ylsulfonylamino)hexanoic acid methyl ester IUPAC Name: methyl 2-[(4-methylphenyl)sulfonylamino]-6-(thiophen-2-ylsulfonylamino)hexanoate Traditional Name: 6-(2-thienylsulfonylamino)-2-(tosylamino)hexanoic acid methyl ester Formula: C18H24N2O6S3 MolecularWeight: 460.58796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCNS(=O)(=O)C2=CC=CS2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCNS(=O)(=O)C2=CC=CS2)C(=O)OC

InChI

InChI=1S/C18H24N2O6S3/c1-14-8-10-15(11-9-14)28(22,23)20-16(18(21)26-2)6-3-4-12-19-29(24,25)17-7-5-13-27-17/h5,7-11,13,16,19-20H,3-4,6,12H2,1-2H3