(2S)-5-chloranyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)-2,3-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: (2S)-5-chloranyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: (2S)-N-benzyl-5-chloro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-2,3-dihydrobenzofuran-2-carboxamide CAS Name: (2S)-5-chloro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: (2S)-N-benzyl-5-chloro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: (2S)-N-benzyl-5-chloro-N-[(4-keto-1H-quinazolin-2-yl)methyl]coumaran-2-carboxamide Formula: C25H20ClN3O3 MolecularWeight: 445.8976

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2)Cl)C(=O)N(CC3=CC=CC=C3)CC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

C1[C@H](OC2=C1C=C(C=C2)Cl)C(=O)N(CC3=CC=CC=C3)CC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C25H20ClN3O3/c26-18-10-11-21-17(12-18)13-22(32-21)25(31)29(14-16-6-2-1-3-7-16)15-23-27-20-9-5-4-8-19(20)24(30)28-23/h1-12,22H,13-15H2,(H,27,28,30)/t22-/m0/s1