3-azanylpropan-1-ol; 3-[[4-[2-[(3-methylphenyl)amino]pyrimidin-4-yl]pyridin-2-yl]amino]propan-1-ol

Systemtic Name: 3-azanylpropan-1-ol; 3-[[4-[2-[(3-methylphenyl)amino]pyrimidin-4-yl]pyridin-2-yl]amino]propan-1-ol Openeye Name: 3-aminopropan-1-ol; 3-[[4-[2-(3-methylanilino)pyrimidin-4-yl]-2-pyridyl]amino]propan-1-ol CAS Name: 3-amino-1-propanol; 3-[[4-[2-(3-methylanilino)-4-pyrimidinyl]-2-pyridinyl]amino]-1-propanol IUPAC Name: 3-aminopropan-1-ol; 3-[[4-[2-(3-methylanilino)pyrimidin-4-yl]pyridin-2-yl]amino]propan-1-ol Traditional Name: 3-aminopropan-1-ol; 3-[[4-[2-(m-toluidino)pyrimidin-4-yl]-2-pyridyl]amino]propan-1-ol Formula: C22H30N6O2 MolecularWeight: 410.5126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=CC(=N2)C3=CC(=NC=C3)NCCCO.C(CN)CO

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=CC(=N2)C3=CC(=NC=C3)NCCCO.C(CN)CO

InChI

InChI=1S/C19H21N5O.C3H9NO/c1-14-4-2-5-16(12-14)23-19-22-10-7-17(24-19)15-6-9-21-18(13-15)20-8-3-11-25;4-2-1-3-5/h2,4-7,9-10,12-13,25H,3,8,11H2,1H3,(H,20,21)(H,22,23,24);5H,1-4H2