ethyl 2-[[2-(1-azanyl-2-oxidanyl-ethyl)-1,3-oxazol-4-yl]carbonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: ethyl 2-[[2-(1-azanyl-2-oxidanyl-ethyl)-1,3-oxazol-4-yl]carbonylamino]-6-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: ethyl 2-[[2-(1-amino-2-hydroxy-ethyl)oxazole-4-carbonyl]amino]-6-(p-tolylsulfonylamino)hexanoate CAS Name: 2-[[[2-(1-amino-2-hydroxyethyl)-4-oxazolyl]-oxomethyl]amino]-6-[(4-methylphenyl)sulfonylamino]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[[2-(1-amino-2-hydroxyethyl)-1,3-oxazole-4-carbonyl]amino]-6-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 2-[[2-(1-amino-2-hydroxy-ethyl)oxazole-4-carbonyl]amino]-6-(tosylamino)hexanoic acid ethyl ester Formula: C21H30N4O7S MolecularWeight: 482.5505

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NC(=O)C2=COC(=N2)C(CO)N

Isomeric SMILES

CCOC(=O)C(CCCCNS(=O)(=O)C1=CC=C(C=C1)C)NC(=O)C2=COC(=N2)C(CO)N

InChI

InChI=1S/C21H30N4O7S/c1-3-31-21(28)17(24-19(27)18-13-32-20(25-18)16(22)12-26)6-4-5-11-23-33(29,30)15-9-7-14(2)8-10-15/h7-10,13,16-17,23,26H,3-6,11-12,22H2,1-2H3,(H,24,27)