2-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-(2-hydroxyethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-(2-hydroxyethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[(2-benzyloxy-5-bromo-phenyl)methyl-ethyl-amino]-N-(2-hydroxyethyl)thiazole-4-carboxamide CAS Name: 2-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-N-(2-hydroxyethyl)-4-thiazolecarboxamide IUPAC Name: 2-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-N-(2-hydroxyethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[(2-benzoxy-5-bromo-benzyl)-ethyl-amino]-N-(2-hydroxyethyl)thiazole-4-carboxamide Formula: C22H24BrN3O3S MolecularWeight: 490.41326

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=NC(=CS3)C(=O)NCCO

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=NC(=CS3)C(=O)NCCO

InChI

InChI=1S/C22H24BrN3O3S/c1-2-26(22-25-19(15-30-22)21(28)24-10-11-27)13-17-12-18(23)8-9-20(17)29-14-16-6-4-3-5-7-16/h3-9,12,15,27H,2,10-11,13-14H2,1H3,(H,24,28)