N-(2-azanylethyl)-4-bromanyl-N-[1-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propyl]benzamide

Systemtic Name: N-(2-azanylethyl)-4-bromanyl-N-[1-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]propyl]benzamide Openeye Name: N-(2-aminoethyl)-N-[1-(3-benzyl-4-oxo-quinazolin-2-yl)propyl]-4-bromo-benzamide CAS Name: N-(2-aminoethyl)-4-bromo-N-[1-[4-oxo-3-(phenylmethyl)-2-quinazolinyl]propyl]benzamide IUPAC Name: N-(2-aminoethyl)-N-[1-(3-benzyl-4-oxoquinazolin-2-yl)propyl]-4-bromobenzamide Traditional Name: N-(2-aminoethyl)-N-[1-(3-benzyl-4-keto-quinazolin-2-yl)propyl]-4-bromo-benzamide Formula: C27H27BrN4O2 MolecularWeight: 519.43288

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3)N(CCN)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCC(C1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3)N(CCN)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C27H27BrN4O2/c1-2-24(31(17-16-29)26(33)20-12-14-21(28)15-13-20)25-30-23-11-7-6-10-22(23)27(34)32(25)18-19-8-4-3-5-9-19/h3-15,24H,2,16-18,29H2,1H3