(3S)-N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide

Systemtic Name: (3S)-N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide Openeye Name: (3S)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-1-oxo-3-phenyl-isochromane-6-carboxamide CAS Name: (3S)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: (3S)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-1-oxo-3-phenyl-3,4-dihydroisochromene-6-carboxamide Traditional Name: (3S)-N-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-N-ethyl-1-keto-3-phenyl-isochroman-6-carboxamide Formula: C27H22ClN3O4 MolecularWeight: 487.93428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3=CC4=C(C=C3)C(=O)OC(C4)C5=CC=CC=C5

Isomeric SMILES

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3=CC4=C(C=C3)C(=O)O[C@@H](C4)C5=CC=CC=C5

InChI

InChI=1S/C27H22ClN3O4/c1-2-31(15-24-29-22-14-19(28)9-11-21(22)25(32)30-24)26(33)17-8-10-20-18(12-17)13-23(35-27(20)34)16-6-4-3-5-7-16/h3-12,14,23H,2,13,15H2,1H3,(H,29,30,32)/t23-/m0/s1