methyl 2-[2-[3-[(4-tert-butylphenyl)carbonylamino]propanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: methyl 2-[2-[3-[(4-tert-butylphenyl)carbonylamino]propanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: methyl 2-[2-[3-[(4-tert-butylbenzoyl)amino]propanoylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[3-[[(4-tert-butylphenyl)-oxomethyl]amino]-1-oxopropyl]amino]-4-thiazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[3-[(4-tert-butylbenzoyl)amino]propanoylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[3-[(4-tert-butylbenzoyl)amino]propanoylamino]thiazol-4-yl]acetic acid methyl ester Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCC(=O)NC2=NC(=CS2)CC(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCC(=O)NC2=NC(=CS2)CC(=O)OC

InChI

InChI=1S/C20H25N3O4S/c1-20(2,3)14-7-5-13(6-8-14)18(26)21-10-9-16(24)23-19-22-15(12-28-19)11-17(25)27-4/h5-8,12H,9-11H2,1-4H3,(H,21,26)(H,22,23,24)