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

Systemtic Name: methyl 2-[[(2-bromophenyl)carbamoyl-pentyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(2-bromophenyl)carbamoyl-pentyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(2-bromoanilino)-oxomethyl]-pentylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(2-bromophenyl)carbamoyl-pentylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[amyl-[(2-bromophenyl)carbamoyl]amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C18H22BrN3O3S MolecularWeight: 440.35458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22BrN3O3S/c1-3-4-7-10-22(11-16-20-15(12-26-16)17(23)25-2)18(24)21-14-9-6-5-8-13(14)19/h5-6,8-9,12H,3-4,7,10-11H2,1-2H3,(H,21,24)