1-methyl-3-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-1-(3-oxidanylpropyl)urea

Systemtic Name: 1-methyl-3-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]-1-(3-oxidanylpropyl)urea Openeye Name: 1-(3-hydroxypropyl)-1-methyl-3-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]urea CAS Name: 1-(3-hydroxypropyl)-1-methyl-3-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]urea IUPAC Name: 1-(3-hydroxypropyl)-1-methyl-3-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]urea Traditional Name: 1-(3-hydroxypropyl)-1-methyl-3-[4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]urea Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N(C)CCCO)NC2=NC=CC(=N2)C3=CN=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N(C)CCCO)NC2=NC=CC(=N2)C3=CN=CC=C3

InChI

InChI=1S/C21H24N6O2/c1-15-6-7-17(24-21(29)27(2)11-4-12-28)13-19(15)26-20-23-10-8-18(25-20)16-5-3-9-22-14-16/h3,5-10,13-14,28H,4,11-12H2,1-2H3,(H,24,29)(H,23,25,26)