ethyl 4-[[hexyl-[1-(3-naphthalen-2-yl-4-oxidanylidene-quinazolin-2-yl)ethyl]carbamoyl]amino]benzoate

Systemtic Name: ethyl 4-[[hexyl-[1-(3-naphthalen-2-yl-4-oxidanylidene-quinazolin-2-yl)ethyl]carbamoyl]amino]benzoate Openeye Name: ethyl 4-[[hexyl-[1-[3-(2-naphthyl)-4-oxo-quinazolin-2-yl]ethyl]carbamoyl]amino]benzoate CAS Name: 4-[[[hexyl-[1-[3-(2-naphthalenyl)-4-oxo-2-quinazolinyl]ethyl]amino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[hexyl-[1-(3-naphthalen-2-yl-4-oxoquinazolin-2-yl)ethyl]carbamoyl]amino]benzoate Traditional Name: 4-[[hexyl-[1-[4-keto-3-(2-naphthyl)quinazolin-2-yl]ethyl]carbamoyl]amino]benzoic acid ethyl ester Formula: C36H38N4O4 MolecularWeight: 590.71132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC4=CC=CC=C4C=C3)C(=O)NC5=CC=C(C=C5)C(=O)OCC

Isomeric SMILES

CCCCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC4=CC=CC=C4C=C3)C(=O)NC5=CC=C(C=C5)C(=O)OCC

InChI

InChI=1S/C36H38N4O4/c1-4-6-7-12-23-39(36(43)37-29-20-17-27(18-21-29)35(42)44-5-2)25(3)33-38-32-16-11-10-15-31(32)34(41)40(33)30-22-19-26-13-8-9-14-28(26)24-30/h8-11,13-22,24-25H,4-7,12,23H2,1-3H3,(H,37,43)