ethyl 5-methyl-3-phenyl-4-(2-phenylazanylpyrimidin-4-yl)-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 5-methyl-3-phenyl-4-(2-phenylazanylpyrimidin-4-yl)-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-(2-anilinopyrimidin-4-yl)-5-methyl-3-phenyl-1H-pyrrole-2-carboxylate CAS Name: 4-(2-anilino-4-pyrimidinyl)-5-methyl-3-phenyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-anilinopyrimidin-4-yl)-5-methyl-3-phenyl-1H-pyrrole-2-carboxylate Traditional Name: 4-(2-anilinopyrimidin-4-yl)-5-methyl-3-phenyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C24H22N4O2 MolecularWeight: 398.45708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C2=NC(=NC=C2)NC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C2=NC(=NC=C2)NC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H22N4O2/c1-3-30-23(29)22-21(17-10-6-4-7-11-17)20(16(2)26-22)19-14-15-25-24(28-19)27-18-12-8-5-9-13-18/h4-15,26H,3H2,1-2H3,(H,25,27,28)