5-(4-bromophenyl)-N-[2-(4-ethoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-[2-(4-ethoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(4-bromophenyl)-N-[2-(4-ethoxyphenyl)-2-pyrrolidin-1-yl-ethyl]isoxazole-3-carboxamide CAS Name: 5-(4-bromophenyl)-N-[2-(4-ethoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-3-isoxazolecarboxamide IUPAC Name: 5-(4-bromophenyl)-N-[2-(4-ethoxyphenyl)-2-pyrrolidin-1-ylethyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(4-bromophenyl)-N-(2-p-phenetyl-2-pyrrolidino-ethyl)isoxazole-3-carboxamide Formula: C24H26BrN3O3 MolecularWeight: 484.38554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(CNC(=O)C2=NOC(=C2)C3=CC=C(C=C3)Br)N4CCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)C(CNC(=O)C2=NOC(=C2)C3=CC=C(C=C3)Br)N4CCCC4

InChI

InChI=1S/C24H26BrN3O3/c1-2-30-20-11-7-17(8-12-20)22(28-13-3-4-14-28)16-26-24(29)21-15-23(31-27-21)18-5-9-19(25)10-6-18/h5-12,15,22H,2-4,13-14,16H2,1H3,(H,26,29)