ethyl 2-[[3-methyl-2,5-bis(oxidanylidene)pyrrol-1-yl]amino]-4-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[[3-methyl-2,5-bis(oxidanylidene)pyrrol-1-yl]amino]-4-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 2-[(3-methyl-2,5-dioxo-pyrrol-1-yl)amino]-4-phenyl-pyrimidine-5-carboxylate CAS Name: 2-[(3-methyl-2,5-dioxo-1-pyrrolyl)amino]-4-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-methyl-2,5-dioxopyrrol-1-yl)amino]-4-phenylpyrimidine-5-carboxylate Traditional Name: 2-(citraconimidoamino)-4-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H16N4O4 MolecularWeight: 352.34404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1C2=CC=CC=C2)NN3C(=O)C=C(C3=O)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1C2=CC=CC=C2)NN3C(=O)C=C(C3=O)C

InChI

InChI=1S/C18H16N4O4/c1-3-26-17(25)13-10-19-18(20-15(13)12-7-5-4-6-8-12)21-22-14(23)9-11(2)16(22)24/h4-10H,3H2,1-2H3,(H,19,20,21)