N-[2-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[2-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-[2-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-[2-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-2-(4-quinazolinylthio)acetamide IUPAC Name: N-[2-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-[2-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-2-(quinazolin-4-ylthio)acetamide Formula: C23H15ClN4O2S MolecularWeight: 446.9088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NC3=CC=CC=C3C4=NC5=C(O4)C=CC(=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)SCC(=O)NC3=CC=CC=C3C4=NC5=C(O4)C=CC(=C5)Cl

InChI

InChI=1S/C23H15ClN4O2S/c24-14-9-10-20-19(11-14)28-22(30-20)15-5-1-4-8-18(15)27-21(29)12-31-23-16-6-2-3-7-17(16)25-13-26-23/h1-11,13H,12H2,(H,27,29)