tert-butyl N-[2-methyl-5-(pyridin-3-ylcarbonylamino)phenyl]-N-(4-pyridin-3-ylpyrimidin-2-yl)carbamate

Systemtic Name: tert-butyl N-[2-methyl-5-(pyridin-3-ylcarbonylamino)phenyl]-N-(4-pyridin-3-ylpyrimidin-2-yl)carbamate Openeye Name: tert-butyl N-[2-methyl-5-(pyridine-3-carbonylamino)phenyl]-N-[4-(3-pyridyl)pyrimidin-2-yl]carbamate CAS Name: N-[2-methyl-5-[[oxo(3-pyridinyl)methyl]amino]phenyl]-N-[4-(3-pyridinyl)-2-pyrimidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-methyl-5-(pyridine-3-carbonylamino)phenyl]-N-(4-pyridin-3-ylpyrimidin-2-yl)carbamate Traditional Name: N-(2-methyl-5-nicotinamido-phenyl)-N-[4-(3-pyridyl)pyrimidin-2-yl]carbamic acid tert-butyl ester Formula: C27H26N6O3 MolecularWeight: 482.53374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CN=CC=C2)N(C3=NC=CC(=N3)C4=CN=CC=C4)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CN=CC=C2)N(C3=NC=CC(=N3)C4=CN=CC=C4)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H26N6O3/c1-18-9-10-21(31-24(34)20-8-6-13-29-17-20)15-23(18)33(26(35)36-27(2,3)4)25-30-14-11-22(32-25)19-7-5-12-28-16-19/h5-17H,1-4H3,(H,31,34)