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

Systemtic Name: [3-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] adamantane-1-carboxylate Openeye Name: [3-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [3-[3-(cyclohexylamino)-7-methyl-2-imidazo[1,2-a]pyridinyl]phenyl] ester IUPAC Name: [3-[3-(cyclohexylamino)-7-methylimidazo[1,2-a]pyridin-2-yl]phenyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [3-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] ester Formula: C31H37N3O2 MolecularWeight: 483.64438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(N2C=C1)NC3CCCCC3)C4=CC(=CC=C4)OC(=O)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CC1=CC2=NC(=C(N2C=C1)NC3CCCCC3)C4=CC(=CC=C4)OC(=O)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C31H37N3O2/c1-20-10-11-34-27(12-20)33-28(29(34)32-25-7-3-2-4-8-25)24-6-5-9-26(16-24)36-30(35)31-17-21-13-22(18-31)15-23(14-21)19-31/h5-6,9-12,16,21-23,25,32H,2-4,7-8,13-15,17-19H2,1H3