4-fluoranyl-N-[4-oxidanylidene-2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-quinazolin-3-yl]benzamide

Systemtic Name: 4-fluoranyl-N-[4-oxidanylidene-2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-quinazolin-3-yl]benzamide Openeye Name: N-[2-[2-(benzylamino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]-4-fluoro-benzamide CAS Name: 4-fluoro-N-[4-oxo-2-[[2-oxo-2-[(phenylmethyl)amino]ethyl]thio]-3-quinazolinyl]benzamide IUPAC Name: N-[2-[2-(benzylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]-4-fluorobenzamide Traditional Name: N-[2-[[2-(benzylamino)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]-4-fluoro-benzamide Formula: C24H19FN4O3S MolecularWeight: 462.496063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H19FN4O3S/c25-18-12-10-17(11-13-18)22(31)28-29-23(32)19-8-4-5-9-20(19)27-24(29)33-15-21(30)26-14-16-6-2-1-3-7-16/h1-13H,14-15H2,(H,26,30)(H,28,31)