N-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide

Systemtic Name: N-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide Openeye Name: N-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide CAS Name: N-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide IUPAC Name: N-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide Traditional Name: N-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]-4-(4-keto-1H-quinazolin-2-yl)butyramide Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)NC(=O)CCCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)NC(=O)CCCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C23H25N3O4/c1-3-29-20-12-15-11-14(2)30-19(15)13-18(20)25-22(27)10-6-9-21-24-17-8-5-4-7-16(17)23(28)26-21/h4-5,7-8,12-14H,3,6,9-11H2,1-2H3,(H,25,27)(H,24,26,28)/t14-/m0/s1