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

Systemtic Name: ethyl 2-[[(2-bromophenyl)carbamoyl-pentyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(2-bromophenyl)carbamoyl-pentyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(2-bromoanilino)-oxomethyl]-pentylamino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(2-bromophenyl)carbamoyl-pentylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[amyl-[(2-bromophenyl)carbamoyl]amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C19H24BrN3O3S MolecularWeight: 454.38116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=NC(=CS1)C(=O)OCC)C(=O)NC2=CC=CC=C2Br

Isomeric SMILES

CCCCCN(CC1=NC(=CS1)C(=O)OCC)C(=O)NC2=CC=CC=C2Br

InChI

InChI=1S/C19H24BrN3O3S/c1-3-5-8-11-23(19(25)22-15-10-7-6-9-14(15)20)12-17-21-16(13-27-17)18(24)26-4-2/h6-7,9-10,13H,3-5,8,11-12H2,1-2H3,(H,22,25)