N-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-5-[(4-butan-2-ylphenoxy)methyl]furan-2-carboxamide

Systemtic Name: N-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-5-[(4-butan-2-ylphenoxy)methyl]furan-2-carboxamide Openeye Name: N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-5-[(4-sec-butylphenoxy)methyl]furan-2-carboxamide CAS Name: N-[3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]phenyl]-5-[(4-butan-2-ylphenoxy)methyl]-2-furancarboxamide IUPAC Name: N-[3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]phenyl]-5-[(4-butan-2-ylphenoxy)methyl]furan-2-carboxamide Traditional Name: N-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]-5-[(4-sec-butylphenoxy)methyl]-2-furamide Formula: C28H30BrN3O3 MolecularWeight: 536.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=CC=CC(=C3)CN4C(=C(C(=N4)C)Br)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=CC=CC(=C3)CN4C(=C(C(=N4)C)Br)C

InChI

InChI=1S/C28H30BrN3O3/c1-5-18(2)22-9-11-24(12-10-22)34-17-25-13-14-26(35-25)28(33)30-23-8-6-7-21(15-23)16-32-20(4)27(29)19(3)31-32/h6-15,18H,5,16-17H2,1-4H3,(H,30,33)