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

Systemtic Name: 2-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-[(2S)-2-oxidanylpropyl]-1,3-thiazole-5-carboxamide Openeye Name: 2-[(2-benzyloxy-5-bromo-phenyl)methyl-ethyl-amino]-N-[(2S)-2-hydroxypropyl]thiazole-5-carboxamide CAS Name: 2-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-N-[(2S)-2-hydroxypropyl]-5-thiazolecarboxamide IUPAC Name: 2-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-N-[(2S)-2-hydroxypropyl]-1,3-thiazole-5-carboxamide Traditional Name: 2-[(2-benzoxy-5-bromo-benzyl)-ethyl-amino]-N-[(2S)-2-hydroxypropyl]thiazole-5-carboxamide Formula: C23H26BrN3O3S MolecularWeight: 504.43984

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=NC=C(S3)C(=O)NCC(C)O

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=NC=C(S3)C(=O)NC[C@H](C)O

InChI

InChI=1S/C23H26BrN3O3S/c1-3-27(23-26-13-21(31-23)22(29)25-12-16(2)28)14-18-11-19(24)9-10-20(18)30-15-17-7-5-4-6-8-17/h4-11,13,16,28H,3,12,14-15H2,1-2H3,(H,25,29)/t16-/m0/s1