2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2R)-1-methoxypropan-2-yl]ethanamide

Systemtic Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2R)-1-methoxypropan-2-yl]ethanamide Openeye Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-[(1R)-2-methoxy-1-methyl-ethyl]acetamide CAS Name: 2-[[3-[(4-fluorophenyl)methyl]-4-oxo-2-quinazolinyl]thio]-N-[(2R)-1-methoxypropan-2-yl]acetamide IUPAC Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxoquinazolin-2-yl]sulfanyl-N-[(2R)-1-methoxypropan-2-yl]acetamide Traditional Name: 2-[[3-(4-fluorobenzyl)-4-keto-quinazolin-2-yl]thio]-N-[(1R)-2-methoxy-1-methyl-ethyl]acetamide Formula: C21H22FN3O3S MolecularWeight: 415.481083

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)F

Isomeric SMILES

C[C@H](COC)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)F

InChI

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