methyl 4-[[2-[2-(4-ethylphenyl)-1,3-thiazol-4-yl]ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[2-(4-ethylphenyl)-1,3-thiazol-4-yl]ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-[2-(4-ethylphenyl)thiazol-4-yl]acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-[2-(4-ethylphenyl)-4-thiazolyl]-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[2-(4-ethylphenyl)-1,3-thiazol-4-yl]acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[2-(4-ethylphenyl)thiazol-4-yl]acetyl]amino]methyl]benzoic acid methyl ester Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)CC(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)CC(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H22N2O3S/c1-3-15-4-8-17(9-5-15)21-24-19(14-28-21)12-20(25)23-13-16-6-10-18(11-7-16)22(26)27-2/h4-11,14H,3,12-13H2,1-2H3,(H,23,25)