[2-[6-bromanyl-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 4-tert-butylbenzoate

Systemtic Name: [2-[6-bromanyl-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 4-tert-butylbenzoate Openeye Name: [2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [2-[6-bromo-3-(cyclohexylamino)-2-imidazo[1,2-a]pyridinyl]phenyl] ester IUPAC Name: [2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [2-[6-bromo-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] ester Formula: C30H32BrN3O2 MolecularWeight: 546.49798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C3=C(N4C=C(C=CC4=N3)Br)NC5CCCCC5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C3=C(N4C=C(C=CC4=N3)Br)NC5CCCCC5

InChI

InChI=1S/C30H32BrN3O2/c1-30(2,3)21-15-13-20(14-16-21)29(35)36-25-12-8-7-11-24(25)27-28(32-23-9-5-4-6-10-23)34-19-22(31)17-18-26(34)33-27/h7-8,11-19,23,32H,4-6,9-10H2,1-3H3