methyl 2-[[(4-ethylphenyl)carbamoyl-pentyl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[(4-ethylphenyl)carbamoyl-pentyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(4-ethylphenyl)carbamoyl-pentyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(4-ethylanilino)-oxomethyl]-pentylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4-ethylphenyl)carbamoyl-pentylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[amyl-[(4-ethylphenyl)carbamoyl]amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=NC(=CS1)C(=O)OC)C(=O)NC2=CC=C(C=C2)CC

Isomeric SMILES

CCCCCN(CC1=NC(=CS1)C(=O)OC)C(=O)NC2=CC=C(C=C2)CC

InChI

InChI=1S/C20H27N3O3S/c1-4-6-7-12-23(13-18-22-17(14-27-18)19(24)26-3)20(25)21-16-10-8-15(5-2)9-11-16/h8-11,14H,4-7,12-13H2,1-3H3,(H,21,25)