1-[1-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-(3-fluorophenyl)-1-phenethyl-urea

Systemtic Name: 1-[1-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-(3-fluorophenyl)-1-phenethyl-urea Openeye Name: 1-[1-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]ethyl]-3-(3-fluorophenyl)-1-phenethyl-urea CAS Name: 1-[1-[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]ethyl]-3-(3-fluorophenyl)-1-phenethylurea IUPAC Name: 1-[1-[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]ethyl]-3-(3-fluorophenyl)-1-phenethylurea Traditional Name: 1-[1-[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]ethyl]-3-(3-fluorophenyl)-1-phenethyl-urea Formula: C33H31FN4O2 MolecularWeight: 534.623243

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCC4=CC=CC=C4)C(=O)NC5=CC(=CC=C5)F

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCC4=CC=CC=C4)C(=O)NC5=CC(=CC=C5)F

InChI

InChI=1S/C33H31FN4O2/c1-3-24-16-18-28(19-17-24)38-31(36-30-15-8-7-14-29(30)32(38)39)23(2)37(21-20-25-10-5-4-6-11-25)33(40)35-27-13-9-12-26(34)22-27/h4-19,22-23H,3,20-21H2,1-2H3,(H,35,40)