4-[2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]-N-(phenylmethyl)butanamide

Systemtic Name: 4-[2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-4-[2-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]butanamide CAS Name: 4-[2-[[2-(4-fluorophenyl)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-4-[2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]butanamide Traditional Name: N-benzyl-4-[2-[[2-(4-fluorophenyl)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]butyramide Formula: C27H24FN3O3S MolecularWeight: 489.561163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H24FN3O3S/c28-21-14-12-20(13-15-21)24(32)18-35-27-30-23-10-5-4-9-22(23)26(34)31(27)16-6-11-25(33)29-17-19-7-2-1-3-8-19/h1-5,7-10,12-15H,6,11,16-18H2,(H,29,33)