ethyl 3-[[[3-(2-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]amino]carbamoylamino]benzoate

Systemtic Name: ethyl 3-[[[3-(2-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]amino]carbamoylamino]benzoate Openeye Name: ethyl 3-[[[3-(2-ethylphenyl)-4-oxo-quinazolin-2-yl]amino]carbamoylamino]benzoate CAS Name: 3-[[[[3-(2-ethylphenyl)-4-oxo-2-quinazolinyl]hydrazo]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[[3-(2-ethylphenyl)-4-oxoquinazolin-2-yl]amino]carbamoylamino]benzoate Traditional Name: 3-[[[3-(2-ethylphenyl)-4-keto-quinazolin-2-yl]amino]carbamoylamino]benzoic acid ethyl ester Formula: C26H25N5O4 MolecularWeight: 471.5078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2NNC(=O)NC4=CC=CC(=C4)C(=O)OCC

Isomeric SMILES

CCC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2NNC(=O)NC4=CC=CC(=C4)C(=O)OCC

InChI

InChI=1S/C26H25N5O4/c1-3-17-10-5-8-15-22(17)31-23(32)20-13-6-7-14-21(20)28-25(31)29-30-26(34)27-19-12-9-11-18(16-19)24(33)35-4-2/h5-16H,3-4H2,1-2H3,(H,28,29)(H2,27,30,34)