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

Systemtic Name: 3,5-dimethyl-4-(2-phenylazanylpyrimidin-4-yl)-N-(phenylmethyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-(2-anilinopyrimidin-4-yl)-N-benzyl-3,5-dimethyl-1H-pyrrole-2-carboxamide CAS Name: 4-(2-anilino-4-pyrimidinyl)-3,5-dimethyl-N-(phenylmethyl)-1H-pyrrole-2-carboxamide IUPAC Name: 4-(2-anilinopyrimidin-4-yl)-N-benzyl-3,5-dimethyl-1H-pyrrole-2-carboxamide Traditional Name: 4-(2-anilinopyrimidin-4-yl)-N-benzyl-3,5-dimethyl-1H-pyrrole-2-carboxamide Formula: C24H23N5O MolecularWeight: 397.47232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C2=NC(=NC=C2)NC3=CC=CC=C3)C)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=C(NC(=C1C2=NC(=NC=C2)NC3=CC=CC=C3)C)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C24H23N5O/c1-16-21(20-13-14-25-24(29-20)28-19-11-7-4-8-12-19)17(2)27-22(16)23(30)26-15-18-9-5-3-6-10-18/h3-14,27H,15H2,1-2H3,(H,26,30)(H,25,28,29)