ethyl 2-[[(4-propan-2-ylphenyl)carbamoyl-propyl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[(4-propan-2-ylphenyl)carbamoyl-propyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(4-isopropylphenyl)carbamoyl-propyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[oxo-(4-propan-2-ylanilino)methyl]-propylamino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(4-propan-2-ylphenyl)carbamoyl-propylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[p-cumenylcarbamoyl(propyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=NC(=CS1)C(=O)OCC)C(=O)NC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCCN(CC1=NC(=CS1)C(=O)OCC)C(=O)NC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C20H27N3O3S/c1-5-11-23(12-18-22-17(13-27-18)19(24)26-6-2)20(25)21-16-9-7-15(8-10-16)14(3)4/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,21,25)