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

Systemtic Name: N-(4-fluorophenyl)-2-[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide Openeye Name: N-(4-fluorophenyl)-2-[3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-butanamide CAS Name: N-(4-fluorophenyl)-2-[[3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]thio]butanamide IUPAC Name: N-(4-fluorophenyl)-2-[3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]sulfanylbutanamide Traditional Name: N-(4-fluorophenyl)-2-[[4-keto-3-(3-methoxypropyl)quinazolin-2-yl]thio]butyramide Formula: C22H24FN3O3S MolecularWeight: 429.507663

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)F)SC2=NC3=CC=CC=C3C(=O)N2CCCOC

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)F)SC2=NC3=CC=CC=C3C(=O)N2CCCOC

InChI

InChI=1S/C22H24FN3O3S/c1-3-19(20(27)24-16-11-9-15(23)10-12-16)30-22-25-18-8-5-4-7-17(18)21(28)26(22)13-6-14-29-2/h4-5,7-12,19H,3,6,13-14H2,1-2H3,(H,24,27)