3,5-dimethyl-4-(2-phenylazanylpyrimidin-4-yl)-N-propyl-1H-pyrrole-2-carboxamide

Systemtic Name: 3,5-dimethyl-4-(2-phenylazanylpyrimidin-4-yl)-N-propyl-1H-pyrrole-2-carboxamide Openeye Name: 4-(2-anilinopyrimidin-4-yl)-3,5-dimethyl-N-propyl-1H-pyrrole-2-carboxamide CAS Name: 4-(2-anilino-4-pyrimidinyl)-3,5-dimethyl-N-propyl-1H-pyrrole-2-carboxamide IUPAC Name: 4-(2-anilinopyrimidin-4-yl)-3,5-dimethyl-N-propyl-1H-pyrrole-2-carboxamide Traditional Name: 4-(2-anilinopyrimidin-4-yl)-3,5-dimethyl-N-propyl-1H-pyrrole-2-carboxamide Formula: C20H23N5O MolecularWeight: 349.42952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O/c1-4-11-21-19(26)18-13(2)17(14(3)23-18)16-10-12-22-20(25-16)24-15-8-6-5-7-9-15/h5-10,12,23H,4,11H2,1-3H3,(H,21,26)(H,22,24,25)