N-(3-imidazol-1-ylpropyl)-3-[[2-[(3-methylphenyl)amino]pyrimidin-4-yl]amino]benzamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-3-[[2-[(3-methylphenyl)amino]pyrimidin-4-yl]amino]benzamide Openeye Name: N-(3-imidazol-1-ylpropyl)-3-[[2-(3-methylanilino)pyrimidin-4-yl]amino]benzamide CAS Name: N-[3-(1-imidazolyl)propyl]-3-[[2-(3-methylanilino)-4-pyrimidinyl]amino]benzamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-3-[[2-(3-methylanilino)pyrimidin-4-yl]amino]benzamide Traditional Name: N-(3-imidazol-1-ylpropyl)-3-[[2-(m-toluidino)pyrimidin-4-yl]amino]benzamide Formula: C24H25N7O MolecularWeight: 427.5016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=CC(=N2)NC3=CC=CC(=C3)C(=O)NCCCN4C=CN=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=CC(=N2)NC3=CC=CC(=C3)C(=O)NCCCN4C=CN=C4

InChI

InChI=1S/C24H25N7O/c1-18-5-2-7-20(15-18)29-24-27-11-9-22(30-24)28-21-8-3-6-19(16-21)23(32)26-10-4-13-31-14-12-25-17-31/h2-3,5-9,11-12,14-17H,4,10,13H2,1H3,(H,26,32)(H2,27,28,29,30)