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

Systemtic Name: methyl 2-[[(2,4-dimethoxyphenyl)carbamoyl-pentyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(2,4-dimethoxyphenyl)carbamoyl-pentyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(2,4-dimethoxyanilino)-oxomethyl]-pentylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(2,4-dimethoxyphenyl)carbamoyl-pentylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[amyl-[(2,4-dimethoxyphenyl)carbamoyl]amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C20H27N3O5S MolecularWeight: 421.51048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N3O5S/c1-5-6-7-10-23(12-18-21-16(13-29-18)19(24)28-4)20(25)22-15-9-8-14(26-2)11-17(15)27-3/h8-9,11,13H,5-7,10,12H2,1-4H3,(H,22,25)