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

Systemtic Name: (8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 5-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 5-fluorobenzothiophene-2-carboxylate CAS Name: 5-fluoro-1-benzothiophene-2-carboxylic acid (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 5-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 5-fluorobenzothiophene-2-carboxylic acid (4-keto-8-methyl-1H-quinazolin-2-yl)methyl ester Formula: C19H13FN2O3S MolecularWeight: 368.381523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)C3=CC4=C(S3)C=CC(=C4)F

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)C3=CC4=C(S3)C=CC(=C4)F

InChI

InChI=1S/C19H13FN2O3S/c1-10-3-2-4-13-17(10)21-16(22-18(13)23)9-25-19(24)15-8-11-7-12(20)5-6-14(11)26-15/h2-8H,9H2,1H3,(H,21,22,23)