1-[(3S)-3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl]-2-quinazolin-4-ylsulfanyl-ethanone

Systemtic Name: 1-[(3S)-3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl]-2-quinazolin-4-ylsulfanyl-ethanone Openeye Name: 1-[(3S)-3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl]-2-quinazolin-4-ylsulfanyl-ethanone CAS Name: 1-[(3S)-3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl]-2-(4-quinazolinylthio)ethanone IUPAC Name: 1-[(3S)-3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl]-2-quinazolin-4-ylsulfanylethanone Traditional Name: 1-[(3S)-3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl]-2-(quinazolin-4-ylthio)ethanone Formula: C24H19N3O2S MolecularWeight: 413.49156

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C2=CC=CC=C2O1)C(=O)CSC3=NC=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1[C@@H](N(C2=CC=CC=C2O1)C(=O)CSC3=NC=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C24H19N3O2S/c28-23(15-30-24-18-10-4-5-11-19(18)25-16-26-24)27-20-12-6-7-13-22(20)29-14-21(27)17-8-2-1-3-9-17/h1-13,16,21H,14-15H2/t21-/m1/s1