2-[1-[4-(2-azanylethyl)-2-(3-fluoranyl-4-methyl-phenyl)imidazol-1-yl]-2-methyl-propyl]-7-fluoranyl-3-[(3-methoxyphenyl)methyl]chromen-4-one

Systemtic Name: 2-[1-[4-(2-azanylethyl)-2-(3-fluoranyl-4-methyl-phenyl)imidazol-1-yl]-2-methyl-propyl]-7-fluoranyl-3-[(3-methoxyphenyl)methyl]chromen-4-one Openeye Name: 2-[1-[4-(2-aminoethyl)-2-(3-fluoro-4-methyl-phenyl)imidazol-1-yl]-2-methyl-propyl]-7-fluoro-3-[(3-methoxyphenyl)methyl]chromen-4-one CAS Name: 2-[1-[4-(2-aminoethyl)-2-(3-fluoro-4-methylphenyl)-1-imidazolyl]-2-methylpropyl]-7-fluoro-3-[(3-methoxyphenyl)methyl]-1-benzopyran-4-one IUPAC Name: 2-[1-[4-(2-aminoethyl)-2-(3-fluoro-4-methylphenyl)imidazol-1-yl]-2-methylpropyl]-7-fluoro-3-[(3-methoxyphenyl)methyl]chromen-4-one Traditional Name: 2-[1-[4-(2-aminoethyl)-2-(3-fluoro-4-methyl-phenyl)imidazol-1-yl]-2-methyl-propyl]-7-fluoro-3-m-anisyl-chromone Formula: C33H33F2N3O3 MolecularWeight: 557.630226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC(=CN2C(C3=C(C(=O)C4=C(O3)C=C(C=C4)F)CC5=CC(=CC=C5)OC)C(C)C)CCN)F

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC(=CN2C(C3=C(C(=O)C4=C(O3)C=C(C=C4)F)CC5=CC(=CC=C5)OC)C(C)C)CCN)F

InChI

InChI=1S/C33H33F2N3O3/c1-19(2)30(38-18-24(12-13-36)37-33(38)22-9-8-20(3)28(35)16-22)32-27(15-21-6-5-7-25(14-21)40-4)31(39)26-11-10-23(34)17-29(26)41-32/h5-11,14,16-19,30H,12-13,15,36H2,1-4H3