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

Systemtic Name: (2R)-N-(4-fluorophenyl)-2-[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2R)-N-(4-fluorophenyl)-2-[3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2R)-N-(4-fluorophenyl)-2-[[3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2R)-N-(4-fluorophenyl)-2-[3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2R)-N-(4-fluorophenyl)-2-[[4-keto-3-(3-methoxypropyl)quinazolin-2-yl]thio]propionamide Formula: C21H22FN3O3S MolecularWeight: 415.481083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)F)SC2=NC3=CC=CC=C3C(=O)N2CCCOC

InChI

InChI=1S/C21H22FN3O3S/c1-14(19(26)23-16-10-8-15(22)9-11-16)29-21-24-18-7-4-3-6-17(18)20(27)25(21)12-5-13-28-2/h3-4,6-11,14H,5,12-13H2,1-2H3,(H,23,26)/t14-/m1/s1