N-[1-[3-(4-bromophenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-4-tert-butyl-N-phenethyl-benzamide

Systemtic Name: N-[1-[3-(4-bromophenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-4-tert-butyl-N-phenethyl-benzamide Openeye Name: N-[1-[3-(4-bromophenyl)-4-oxo-quinazolin-2-yl]propyl]-4-tert-butyl-N-phenethyl-benzamide CAS Name: N-[1-[3-(4-bromophenyl)-4-oxo-2-quinazolinyl]propyl]-4-tert-butyl-N-phenethylbenzamide IUPAC Name: N-[1-[3-(4-bromophenyl)-4-oxoquinazolin-2-yl]propyl]-4-tert-butyl-N-phenethylbenzamide Traditional Name: N-[1-[3-(4-bromophenyl)-4-keto-quinazolin-2-yl]propyl]-4-tert-butyl-N-phenethyl-benzamide Formula: C36H36BrN3O2 MolecularWeight: 622.59394

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Br)N(CCC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Br)N(CCC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C36H36BrN3O2/c1-5-32(33-38-31-14-10-9-13-30(31)35(42)40(33)29-21-19-28(37)20-22-29)39(24-23-25-11-7-6-8-12-25)34(41)26-15-17-27(18-16-26)36(2,3)4/h6-22,32H,5,23-24H2,1-4H3