phenyl N-[3-[2-(2-azanylpyrimidin-5-yl)ethynyl]phenyl]carbamate

Systemtic Name: phenyl N-[3-[2-(2-azanylpyrimidin-5-yl)ethynyl]phenyl]carbamate Openeye Name: phenyl N-[3-[2-(2-aminopyrimidin-5-yl)ethynyl]phenyl]carbamate CAS Name: N-[3-[2-(2-amino-5-pyrimidinyl)ethynyl]phenyl]carbamic acid phenyl ester IUPAC Name: phenyl N-[3-[2-(2-aminopyrimidin-5-yl)ethynyl]phenyl]carbamate Traditional Name: N-[3-[2-(2-aminopyrimidin-5-yl)ethynyl]phenyl]carbamic acid phenyl ester Formula: C19H14N4O2 MolecularWeight: 330.34006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)NC2=CC=CC(=C2)C#CC3=CN=C(N=C3)N

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)NC2=CC=CC(=C2)C#CC3=CN=C(N=C3)N

InChI

InChI=1S/C19H14N4O2/c20-18-21-12-15(13-22-18)10-9-14-5-4-6-16(11-14)23-19(24)25-17-7-2-1-3-8-17/h1-8,11-13H,(H,23,24)(H2,20,21,22)