3-[[4-[(2-methylphenyl)amino]pyrimidin-2-yl]amino]benzamide

Systemtic Name: 3-[[4-[(2-methylphenyl)amino]pyrimidin-2-yl]amino]benzamide Openeye Name: 3-[[4-(2-methylanilino)pyrimidin-2-yl]amino]benzamide CAS Name: 3-[[4-(2-methylanilino)-2-pyrimidinyl]amino]benzamide IUPAC Name: 3-[[4-(2-methylanilino)pyrimidin-2-yl]amino]benzamide Traditional Name: 3-[[4-(o-toluidino)pyrimidin-2-yl]amino]benzamide Formula: C18H17N5O MolecularWeight: 319.36048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=NC=C2)NC3=CC=CC(=C3)C(=O)N

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=NC=C2)NC3=CC=CC(=C3)C(=O)N

InChI

InChI=1S/C18H17N5O/c1-12-5-2-3-8-15(12)22-16-9-10-20-18(23-16)21-14-7-4-6-13(11-14)17(19)24/h2-11H,1H3,(H2,19,24)(H2,20,21,22,23)