(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 5-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 5-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: (6-chloro-4-oxo-1H-quinazolin-2-yl)methyl 5-fluorobenzothiophene-2-carboxylate CAS Name: 5-fluoro-1-benzothiophene-2-carboxylic acid (6-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (6-chloro-4-oxo-1H-quinazolin-2-yl)methyl 5-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 5-fluorobenzothiophene-2-carboxylic acid (6-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C18H10ClFN2O3S MolecularWeight: 388.800003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1F)C=C(S2)C(=O)OCC3=NC(=O)C4=C(N3)C=CC(=C4)Cl

Isomeric SMILES

C1=CC2=C(C=C1F)C=C(S2)C(=O)OCC3=NC(=O)C4=C(N3)C=CC(=C4)Cl

InChI

InChI=1S/C18H10ClFN2O3S/c19-10-1-3-13-12(7-10)17(23)22-16(21-13)8-25-18(24)15-6-9-5-11(20)2-4-14(9)26-15/h1-7H,8H2,(H,21,22,23)