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

Systemtic Name: [2-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] adamantane-1-carboxylate Openeye Name: [2-[3-(cyclohexylamino)-7-methyl-imidazo[1,2-a]pyridin-2-yl]phenyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [2-[3-(cyclohexylamino)-7-methyl-2-imidazo[1,2-a]pyridinyl]phenyl] ester IUPAC Name: [2-[3-(cyclohexylamino)-7-methylimidazo[1,2-a]pyridin-2-yl]phenyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [2-[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=C4OC(=O)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CC1=CC2=NC(=C(N2C=C1)NC3CCCCC3)C4=CC=CC=C4OC(=O)C56CC7CC(C5)CC(C7)C6

InChI

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