methyl 2-[[2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanoyl]amino]ethanoate

Systemtic Name: methyl 2-[[2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanoyl]amino]ethanoate Openeye Name: methyl 2-[[4-methylsulfanyl-2-(p-tolylsulfonylamino)butanoyl]amino]acetate CAS Name: 2-[[2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)-1-oxobutyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanoyl]amino]acetate Traditional Name: 2-[[4-(methylthio)-2-(tosylamino)butanoyl]amino]acetic acid methyl ester Formula: C15H22N2O5S2 MolecularWeight: 374.47558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCC(=O)OC

InChI

InChI=1S/C15H22N2O5S2/c1-11-4-6-12(7-5-11)24(20,21)17-13(8-9-23-3)15(19)16-10-14(18)22-2/h4-7,13,17H,8-10H2,1-3H3,(H,16,19)