methyl 3-[2-[3-[(5-methylpyrazin-2-yl)carbonylamino]phenyl]ethynyl]benzoate

Systemtic Name: methyl 3-[2-[3-[(5-methylpyrazin-2-yl)carbonylamino]phenyl]ethynyl]benzoate Openeye Name: methyl 3-[2-[3-[(5-methylpyrazine-2-carbonyl)amino]phenyl]ethynyl]benzoate CAS Name: 3-[2-[3-[[(5-methyl-2-pyrazinyl)-oxomethyl]amino]phenyl]ethynyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[3-[(5-methylpyrazine-2-carbonyl)amino]phenyl]ethynyl]benzoate Traditional Name: 3-[2-[3-[(5-methylpyrazinoyl)amino]phenyl]ethynyl]benzoic acid methyl ester Formula: C22H17N3O3 MolecularWeight: 371.38868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC(=CC=C3)C(=O)OC

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC(=CC=C3)C(=O)OC

InChI

InChI=1S/C22H17N3O3/c1-15-13-24-20(14-23-15)21(26)25-19-8-4-6-17(12-19)10-9-16-5-3-7-18(11-16)22(27)28-2/h3-8,11-14H,1-2H3,(H,25,26)