1-[3-[2-(2-azanylpyrimidin-5-yl)ethynyl]phenyl]-3-(2,2-dimethyloxan-4-yl)urea

Systemtic Name: 1-[3-[2-(2-azanylpyrimidin-5-yl)ethynyl]phenyl]-3-(2,2-dimethyloxan-4-yl)urea Openeye Name: 1-[3-[2-(2-aminopyrimidin-5-yl)ethynyl]phenyl]-3-(2,2-dimethyltetrahydropyran-4-yl)urea CAS Name: 1-[3-[2-(2-amino-5-pyrimidinyl)ethynyl]phenyl]-3-(2,2-dimethyl-4-oxanyl)urea IUPAC Name: 1-[3-[2-(2-aminopyrimidin-5-yl)ethynyl]phenyl]-3-(2,2-dimethyloxan-4-yl)urea Traditional Name: 1-[3-[2-(2-aminopyrimidin-5-yl)ethynyl]phenyl]-3-(2,2-dimethyltetrahydropyran-4-yl)urea Formula: C20H23N5O2 MolecularWeight: 365.42892

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)NC(=O)NC2=CC=CC(=C2)C#CC3=CN=C(N=C3)N)C

Isomeric SMILES

CC1(CC(CCO1)NC(=O)NC2=CC=CC(=C2)C#CC3=CN=C(N=C3)N)C

InChI

InChI=1S/C20H23N5O2/c1-20(2)11-17(8-9-27-20)25-19(26)24-16-5-3-4-14(10-16)6-7-15-12-22-18(21)23-13-15/h3-5,10,12-13,17H,8-9,11H2,1-2H3,(H2,21,22,23)(H2,24,25,26)