N-ethyl-4-[[1-methyl-2,4-bis(oxidanylidene)-6-(3-phenylprop-1-ynyl)quinazolin-3-yl]methyl]benzamide

Systemtic Name: N-ethyl-4-[[1-methyl-2,4-bis(oxidanylidene)-6-(3-phenylprop-1-ynyl)quinazolin-3-yl]methyl]benzamide Openeye Name: N-ethyl-4-[[1-methyl-2,4-dioxo-6-(3-phenylprop-1-ynyl)quinazolin-3-yl]methyl]benzamide CAS Name: N-ethyl-4-[[1-methyl-2,4-dioxo-6-(3-phenylprop-1-ynyl)-3-quinazolinyl]methyl]benzamide IUPAC Name: N-ethyl-4-[[1-methyl-2,4-dioxo-6-(3-phenylprop-1-ynyl)quinazolin-3-yl]methyl]benzamide Traditional Name: 4-[[2,4-diketo-1-methyl-6-(3-phenylprop-1-ynyl)quinazolin-3-yl]methyl]-N-ethyl-benzamide Formula: C28H25N3O3 MolecularWeight: 451.5164

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)C#CCC4=CC=CC=C4)N(C2=O)C

Isomeric SMILES

CCNC(=O)C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)C#CCC4=CC=CC=C4)N(C2=O)C

InChI

InChI=1S/C28H25N3O3/c1-3-29-26(32)23-15-12-22(13-16-23)19-31-27(33)24-18-21(14-17-25(24)30(2)28(31)34)11-7-10-20-8-5-4-6-9-20/h4-6,8-9,12-18H,3,10,19H2,1-2H3,(H,29,32)