methyl 2-[[(4-ethylphenyl)carbonyl-propan-2-yl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[(4-ethylphenyl)carbonyl-propan-2-yl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(4-ethylbenzoyl)-isopropyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(4-ethylphenyl)-oxomethyl]-propan-2-ylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4-ethylbenzoyl)-propan-2-ylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(4-ethylbenzoyl)-isopropyl-amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N(CC2=NC(=CS2)C(=O)OC)C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N(CC2=NC(=CS2)C(=O)OC)C(C)C

InChI

InChI=1S/C18H22N2O3S/c1-5-13-6-8-14(9-7-13)17(21)20(12(2)3)10-16-19-15(11-24-16)18(22)23-4/h6-9,11-12H,5,10H2,1-4H3