N-butyl-4-fluoranyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-butyl-4-fluoranyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-benzothiophene-2-carboxamide Openeye Name: N-butyl-4-fluoro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzothiophene-2-carboxamide CAS Name: N-butyl-4-fluoro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-butyl-4-fluoro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-benzothiophene-2-carboxamide Traditional Name: N-butyl-4-fluoro-N-[(4-keto-1H-quinazolin-2-yl)methyl]benzothiophene-2-carboxamide Formula: C22H20FN3O2S MolecularWeight: 409.476503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC4=C(C=CC=C4S3)F

Isomeric SMILES

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC4=C(C=CC=C4S3)F

InChI

InChI=1S/C22H20FN3O2S/c1-2-3-11-26(13-20-24-17-9-5-4-7-14(17)21(27)25-20)22(28)19-12-15-16(23)8-6-10-18(15)29-19/h4-10,12H,2-3,11,13H2,1H3,(H,24,25,27)