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

Systemtic Name: N-cyclopropyl-3,5-dimethyl-4-(2-phenylazanylpyrimidin-4-yl)-1H-pyrrole-2-carboxamide Openeye Name: 4-(2-anilinopyrimidin-4-yl)-N-cyclopropyl-3,5-dimethyl-1H-pyrrole-2-carboxamide CAS Name: 4-(2-anilino-4-pyrimidinyl)-N-cyclopropyl-3,5-dimethyl-1H-pyrrole-2-carboxamide IUPAC Name: 4-(2-anilinopyrimidin-4-yl)-N-cyclopropyl-3,5-dimethyl-1H-pyrrole-2-carboxamide Traditional Name: 4-(2-anilinopyrimidin-4-yl)-N-cyclopropyl-3,5-dimethyl-1H-pyrrole-2-carboxamide Formula: C20H21N5O MolecularWeight: 347.41364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C2=NC(=NC=C2)NC3=CC=CC=C3)C)C(=O)NC4CC4

Isomeric SMILES

CC1=C(NC(=C1C2=NC(=NC=C2)NC3=CC=CC=C3)C)C(=O)NC4CC4

InChI

InChI=1S/C20H21N5O/c1-12-17(13(2)22-18(12)19(26)23-15-8-9-15)16-10-11-21-20(25-16)24-14-6-4-3-5-7-14/h3-7,10-11,15,22H,8-9H2,1-2H3,(H,23,26)(H,21,24,25)