1-[3-[2-(2-azanylpyrimidin-5-yl)ethynyl]phenyl]-3-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]urea

Systemtic Name: 1-[3-[2-(2-azanylpyrimidin-5-yl)ethynyl]phenyl]-3-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]urea Openeye Name: 1-[3-[2-(2-aminopyrimidin-5-yl)ethynyl]phenyl]-3-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]urea CAS Name: 1-[3-[2-(2-amino-5-pyrimidinyl)ethynyl]phenyl]-3-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]urea IUPAC Name: 1-[3-[2-(2-aminopyrimidin-5-yl)ethynyl]phenyl]-3-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]urea Traditional Name: 1-[3-[2-(2-aminopyrimidin-5-yl)ethynyl]phenyl]-3-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]urea Formula: C20H21N7O MolecularWeight: 375.42704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CCNC(=O)NC2=CC=CC(=C2)C#CC3=CN=C(N=C3)N

Isomeric SMILES

CC1=C(C(=NN1)C)CCNC(=O)NC2=CC=CC(=C2)C#CC3=CN=C(N=C3)N

InChI

InChI=1S/C20H21N7O/c1-13-18(14(2)27-26-13)8-9-22-20(28)25-17-5-3-4-15(10-17)6-7-16-11-23-19(21)24-12-16/h3-5,10-12H,8-9H2,1-2H3,(H,26,27)(H2,21,23,24)(H2,22,25,28)