2-[3-(2-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[3-(2-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[3-(2-fluorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[[3-(2-fluorophenyl)-4-oxo-2-quinazolinyl]thio]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[3-(2-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[[3-(2-fluorophenyl)-4-keto-quinazolin-2-yl]thio]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C23H14FN5O4S2 MolecularWeight: 507.516763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5F

InChI

InChI=1S/C23H14FN5O4S2/c24-15-6-2-4-8-18(15)28-21(31)14-5-1-3-7-16(14)26-23(28)34-12-20(30)27-22-25-17-10-9-13(29(32)33)11-19(17)35-22/h1-11H,12H2,(H,25,27,30)