1-(2-methyl-6-propan-2-yl-phenyl)-3-[4-(2-phenylazanylpyridin-4-yl)pyridin-2-yl]urea

Systemtic Name: 1-(2-methyl-6-propan-2-yl-phenyl)-3-[4-(2-phenylazanylpyridin-4-yl)pyridin-2-yl]urea Openeye Name: 1-[4-(2-anilino-4-pyridyl)-2-pyridyl]-3-(2-isopropyl-6-methyl-phenyl)urea CAS Name: 1-[4-(2-anilino-4-pyridinyl)-2-pyridinyl]-3-(2-methyl-6-propan-2-ylphenyl)urea IUPAC Name: 1-[4-(2-anilinopyridin-4-yl)pyridin-2-yl]-3-(2-methyl-6-propan-2-ylphenyl)urea Traditional Name: 1-[4-(2-anilino-4-pyridyl)-2-pyridyl]-3-(2-isopropyl-6-methyl-phenyl)urea Formula: C27H27N5O MolecularWeight: 437.53618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)NC2=NC=CC(=C2)C3=CC(=NC=C3)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)NC2=NC=CC(=C2)C3=CC(=NC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C27H27N5O/c1-18(2)23-11-7-8-19(3)26(23)32-27(33)31-25-17-21(13-15-29-25)20-12-14-28-24(16-20)30-22-9-5-4-6-10-22/h4-18H,1-3H3,(H,28,30)(H2,29,31,32,33)