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

Systemtic Name: methyl 2-[[(2-bromophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(2-bromophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(2-bromoanilino)-oxomethyl]-(3-methoxypropyl)amino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(2-bromophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(2-bromophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C17H20BrN3O4S MolecularWeight: 442.3274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC1=NC(=CS1)C(=O)OC)C(=O)NC2=CC=CC=C2Br

Isomeric SMILES

COCCCN(CC1=NC(=CS1)C(=O)OC)C(=O)NC2=CC=CC=C2Br

InChI

InChI=1S/C17H20BrN3O4S/c1-24-9-5-8-21(10-15-19-14(11-26-15)16(22)25-2)17(23)20-13-7-4-3-6-12(13)18/h3-4,6-7,11H,5,8-10H2,1-2H3,(H,20,23)