N-(3-imidazol-1-ylpropyl)-3-[[6-[(3-methylphenyl)amino]pyrimidin-4-yl]amino]benzamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-3-[[6-[(3-methylphenyl)amino]pyrimidin-4-yl]amino]benzamide Openeye Name: N-(3-imidazol-1-ylpropyl)-3-[[6-(3-methylanilino)pyrimidin-4-yl]amino]benzamide CAS Name: N-[3-(1-imidazolyl)propyl]-3-[[6-(3-methylanilino)-4-pyrimidinyl]amino]benzamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-3-[[6-(3-methylanilino)pyrimidin-4-yl]amino]benzamide Traditional Name: N-(3-imidazol-1-ylpropyl)-3-[[6-(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=NC(=C2)NC3=CC=CC(=C3)C(=O)NCCCN4C=CN=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=NC(=C2)NC3=CC=CC(=C3)C(=O)NCCCN4C=CN=C4

InChI

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