[4-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] 3-bromanylbenzoate

Systemtic Name: [4-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] 3-bromanylbenzoate Openeye Name: [4-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [4-[3-(cyclohexylamino)-7-methyl-2-imidazo[1,2-a]pyridinyl]phenyl] ester IUPAC Name: [4-[3-(cyclohexylamino)-7-methylimidazo[1,2-a]pyridin-2-yl]phenyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [4-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] ester Formula: C27H26BrN3O2 MolecularWeight: 504.41824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(N2C=C1)NC3CCCCC3)C4=CC=C(C=C4)OC(=O)C5=CC(=CC=C5)Br

Isomeric SMILES

CC1=CC2=NC(=C(N2C=C1)NC3CCCCC3)C4=CC=C(C=C4)OC(=O)C5=CC(=CC=C5)Br

InChI

InChI=1S/C27H26BrN3O2/c1-18-14-15-31-24(16-18)30-25(26(31)29-22-8-3-2-4-9-22)19-10-12-23(13-11-19)33-27(32)20-6-5-7-21(28)17-20/h5-7,10-17,22,29H,2-4,8-9H2,1H3