[2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] phenylmethanesulfonate

Systemtic Name: [2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] phenylmethanesulfonate Openeye Name: [2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] phenylmethanesulfonate CAS Name: phenylmethanesulfonic acid [2-[3-(cyclohexylamino)-2-imidazo[1,2-a]pyridinyl]phenyl] ester IUPAC Name: [2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] phenylmethanesulfonate Traditional Name: phenylmethanesulfonic acid [2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] ester Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C(N=C3N2C=CC=C3)C4=CC=CC=C4OS(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)NC2=C(N=C3N2C=CC=C3)C4=CC=CC=C4OS(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C26H27N3O3S/c30-33(31,19-20-11-3-1-4-12-20)32-23-16-8-7-15-22(23)25-26(27-21-13-5-2-6-14-21)29-18-10-9-17-24(29)28-25/h1,3-4,7-12,15-18,21,27H,2,5-6,13-14,19H2