tert-butyl 4-[2-[(3-methoxyphenyl)amino]pyrimidin-4-yl]-5-methyl-3-phenyl-1H-pyrrole-2-carboxylate

Systemtic Name: tert-butyl 4-[2-[(3-methoxyphenyl)amino]pyrimidin-4-yl]-5-methyl-3-phenyl-1H-pyrrole-2-carboxylate Openeye Name: tert-butyl 4-[2-(3-methoxyanilino)pyrimidin-4-yl]-5-methyl-3-phenyl-1H-pyrrole-2-carboxylate CAS Name: 4-[2-(3-methoxyanilino)-4-pyrimidinyl]-5-methyl-3-phenyl-1H-pyrrole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(3-methoxyanilino)pyrimidin-4-yl]-5-methyl-3-phenyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-(m-anisidino)pyrimidin-4-yl]-5-methyl-3-phenyl-1H-pyrrole-2-carboxylic acid tert-butyl ester Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C(=O)OC(C)(C)C)C2=CC=CC=C2)C3=NC(=NC=C3)NC4=CC(=CC=C4)OC

Isomeric SMILES

CC1=C(C(=C(N1)C(=O)OC(C)(C)C)C2=CC=CC=C2)C3=NC(=NC=C3)NC4=CC(=CC=C4)OC

InChI

InChI=1S/C27H28N4O3/c1-17-22(21-14-15-28-26(31-21)30-19-12-9-13-20(16-19)33-5)23(18-10-7-6-8-11-18)24(29-17)25(32)34-27(2,3)4/h6-16,29H,1-5H3,(H,28,30,31)