[4-[7-methyl-3-(2,4,4-trimethylpentan-2-ylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] (7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl)methanesulfonate

Systemtic Name: [4-[7-methyl-3-(2,4,4-trimethylpentan-2-ylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] (7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl)methanesulfonate Openeye Name: [4-[7-methyl-3-(1,1,3,3-tetramethylbutylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] (7,7-dimethyl-2-oxo-norbornan-1-yl)methanesulfonate CAS Name: (7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)methanesulfonic acid [4-[7-methyl-3-(2,4,4-trimethylpentan-2-ylamino)-2-imidazo[1,2-a]pyridinyl]phenyl] ester IUPAC Name: [4-[7-methyl-3-(2,4,4-trimethylpentan-2-ylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] (7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)methanesulfonate Traditional Name: (2-keto-7,7-dimethyl-norbornan-1-yl)methanesulfonic acid [4-[7-methyl-3-(1,1,3,3-tetramethylbutylamino)imidazo[1,2-a]pyridin-2-yl]phenyl] ester Formula: C32H43N3O4S MolecularWeight: 565.76652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(N2C=C1)NC(C)(C)CC(C)(C)C)C3=CC=C(C=C3)OS(=O)(=O)CC45CCC(C4(C)C)CC5=O

Isomeric SMILES

CC1=CC2=NC(=C(N2C=C1)NC(C)(C)CC(C)(C)C)C3=CC=C(C=C3)OS(=O)(=O)CC45CCC(C4(C)C)CC5=O

InChI

InChI=1S/C32H43N3O4S/c1-21-14-16-35-26(17-21)33-27(28(35)34-30(5,6)19-29(2,3)4)22-9-11-24(12-10-22)39-40(37,38)20-32-15-13-23(18-25(32)36)31(32,7)8/h9-12,14,16-17,23,34H,13,15,18-20H2,1-8H3