N-[3-[1-benzofuran-2-ylcarbonyl(cyclohexyl)amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: N-[3-[1-benzofuran-2-ylcarbonyl(cyclohexyl)amino]propyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: N-[3-[benzofuran-2-carbonyl(cyclohexyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: N-[3-[[2-benzofuranyl(oxo)methyl]-cyclohexylamino]propyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: N-[3-[1-benzofuran-2-carbonyl(cyclohexyl)amino]propyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: N-[3-[benzofuran-2-carbonyl(cyclohexyl)amino]propyl]-4-keto-1H-quinazoline-2-carboxamide Formula: C27H28N4O4 MolecularWeight: 472.53562

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C1CCC(CC1)N(CCCNC(=O)C2=NC(=O)C3=CC=CC=C3N2)C(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C27H28N4O4/c32-25-20-12-5-6-13-21(20)29-24(30-25)26(33)28-15-8-16-31(19-10-2-1-3-11-19)27(34)23-17-18-9-4-7-14-22(18)35-23/h4-7,9,12-14,17,19H,1-3,8,10-11,15-16H2,(H,28,33)(H,29,30,32)