2-[2-(2-chloranylethanoylamino)-4-(4-propan-2-ylphenyl)-1,3-thiazol-5-yl]ethanoate

Systemtic Name: 2-[2-(2-chloranylethanoylamino)-4-(4-propan-2-ylphenyl)-1,3-thiazol-5-yl]ethanoate Openeye Name: 2-[2-[(2-chloroacetyl)amino]-4-(4-isopropylphenyl)thiazol-5-yl]acetate CAS Name: 2-[2-[(2-chloro-1-oxoethyl)amino]-4-(4-propan-2-ylphenyl)-5-thiazolyl]acetate IUPAC Name: 2-[2-[(2-chloroacetyl)amino]-4-(4-propan-2-ylphenyl)-1,3-thiazol-5-yl]acetate Traditional Name: 2-[2-[(2-chloroacetyl)amino]-4-p-cumenyl-thiazol-5-yl]acetate Formula: C16H16ClN2O3S- MolecularWeight: 351.82784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)CCl)CC(=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)CCl)CC(=O)[O-]

InChI

InChI=1S/C16H17ClN2O3S/c1-9(2)10-3-5-11(6-4-10)15-12(7-14(21)22)23-16(19-15)18-13(20)8-17/h3-6,9H,7-8H2,1-2H3,(H,21,22)(H,18,19,20)/p-1