ethyl 3-[[4-oxidanylidene-3-(3-propan-2-yloxyphenyl)quinazolin-2-yl]methylcarbamoylamino]benzoate

Systemtic Name: ethyl 3-[[4-oxidanylidene-3-(3-propan-2-yloxyphenyl)quinazolin-2-yl]methylcarbamoylamino]benzoate Openeye Name: ethyl 3-[[3-(3-isopropoxyphenyl)-4-oxo-quinazolin-2-yl]methylcarbamoylamino]benzoate CAS Name: 3-[[oxo-[[4-oxo-3-(3-propan-2-yloxyphenyl)-2-quinazolinyl]methylamino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-oxo-3-(3-propan-2-yloxyphenyl)quinazolin-2-yl]methylcarbamoylamino]benzoate Traditional Name: 3-[[3-(3-isopropoxyphenyl)-4-keto-quinazolin-2-yl]methylcarbamoylamino]benzoic acid ethyl ester Formula: C28H28N4O5 MolecularWeight: 500.54572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)NCC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)OC(C)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)NCC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)OC(C)C

InChI

InChI=1S/C28H28N4O5/c1-4-36-27(34)19-9-7-10-20(15-19)30-28(35)29-17-25-31-24-14-6-5-13-23(24)26(33)32(25)21-11-8-12-22(16-21)37-18(2)3/h5-16,18H,4,17H2,1-3H3,(H2,29,30,35)