2-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-3-phenyl-quinazolin-4-one

Systemtic Name: 2-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-3-phenyl-quinazolin-4-one Openeye Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-3-phenyl-quinazolin-4-one CAS Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-3-phenyl-4-quinazolinone IUPAC Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-3-phenylquinazolin-4-one Traditional Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-3-phenyl-quinazolin-4-one Formula: C22H15ClN2O3S MolecularWeight: 422.8841

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5)Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5)Cl

InChI

InChI=1S/C22H15ClN2O3S/c23-17-10-14(11-19-20(17)28-13-27-19)12-29-22-24-18-9-5-4-8-16(18)21(26)25(22)15-6-2-1-3-7-15/h1-11H,12-13H2