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

Systemtic Name: 3-[[4-[(3-methylphenyl)amino]pyrimidin-2-yl]amino]phenol Openeye Name: 3-[[4-(3-methylanilino)pyrimidin-2-yl]amino]phenol CAS Name: 3-[[4-(3-methylanilino)-2-pyrimidinyl]amino]phenol IUPAC Name: 3-[[4-(3-methylanilino)pyrimidin-2-yl]amino]phenol Traditional Name: 3-[[4-(m-toluidino)pyrimidin-2-yl]amino]phenol Formula: C17H16N4O MolecularWeight: 292.33514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC(=NC=C2)NC3=CC(=CC=C3)O

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC(=NC=C2)NC3=CC(=CC=C3)O

InChI

InChI=1S/C17H16N4O/c1-12-4-2-5-13(10-12)19-16-8-9-18-17(21-16)20-14-6-3-7-15(22)11-14/h2-11,22H,1H3,(H2,18,19,20,21)