[4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] naphthalene-1-sulfonate

Systemtic Name: [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] naphthalene-1-sulfonate Openeye Name: [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] naphthalene-1-sulfonate CAS Name: 1-naphthalenesulfonic acid [4-[3-(cyclohexylamino)-2-imidazo[1,2-a]pyridinyl]phenyl] ester IUPAC Name: [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] naphthalene-1-sulfonate Traditional Name: naphthalene-1-sulfonic acid [4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] ester Formula: C29H27N3O3S MolecularWeight: 497.60798

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C(N=C3N2C=CC=C3)C4=CC=C(C=C4)OS(=O)(=O)C5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1CCC(CC1)NC2=C(N=C3N2C=CC=C3)C4=CC=C(C=C4)OS(=O)(=O)C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C29H27N3O3S/c33-36(34,26-14-8-10-21-9-4-5-13-25(21)26)35-24-18-16-22(17-19-24)28-29(30-23-11-2-1-3-12-23)32-20-7-6-15-27(32)31-28/h4-10,13-20,23,30H,1-3,11-12H2