ethyl 5-methyl-1-[4-(pyrazin-2-ylcarbonylamino)phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[4-(pyrazin-2-ylcarbonylamino)phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[4-(pyrazine-2-carbonylamino)phenyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[4-[[oxo(2-pyrazinyl)methyl]amino]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[4-(pyrazine-2-carbonylamino)phenyl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[4-(pyrazinoylamino)phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C18H17N5O3 MolecularWeight: 351.35928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)NC(=O)C3=NC=CN=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)NC(=O)C3=NC=CN=C3)C

InChI

InChI=1S/C18H17N5O3/c1-3-26-18(25)15-10-21-23(12(15)2)14-6-4-13(5-7-14)22-17(24)16-11-19-8-9-20-16/h4-11H,3H2,1-2H3,(H,22,24)