4-methylbenzenesulfonic acid; 2-methylsulfanylethyl 2-(2-azanylethanoylamino)ethanoate

Systemtic Name: 4-methylbenzenesulfonic acid; 2-methylsulfanylethyl 2-(2-azanylethanoylamino)ethanoate Openeye Name: 4-methylbenzenesulfonic acid; 2-methylsulfanylethyl 2-[(2-aminoacetyl)amino]acetate CAS Name: 2-[(2-amino-1-oxoethyl)amino]acetic acid 2-(methylthio)ethyl ester; 4-methylbenzenesulfonic acid IUPAC Name: 4-methylbenzenesulfonic acid; 2-methylsulfanylethyl 2-[(2-aminoacetyl)amino]acetate Traditional Name: 2-(glycylamino)acetic acid 2-(methylthio)ethyl ester; tosylic acid Formula: C14H22N2O6S2 MolecularWeight: 378.46428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CSCCOC(=O)CNC(=O)CN

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CSCCOC(=O)CNC(=O)CN

InChI

InChI=1S/C7H14N2O3S.C7H8O3S/c1-13-3-2-12-7(11)5-9-6(10)4-8;1-6-2-4-7(5-3-6)11(8,9)10/h2-5,8H2,1H3,(H,9,10);2-5H,1H3,(H,8,9,10)