N-[(4-fluorophenyl)methyl]-2-[3-(4-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-[3-(4-methylpyridin-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-[3-(4-methyl-2-pyridyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-[(4-fluorophenyl)methyl]-2-[[3-(4-methyl-2-pyridinyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2-[3-(4-methylpyridin-2-yl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(4-fluorobenzyl)-2-[[4-keto-3-(4-methyl-2-pyridyl)quinazolin-2-yl]thio]propionamide Formula: C24H21FN4O2S MolecularWeight: 448.512543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=NC=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C24H21FN4O2S/c1-15-11-12-26-21(13-15)29-23(31)19-5-3-4-6-20(19)28-24(29)32-16(2)22(30)27-14-17-7-9-18(25)10-8-17/h3-13,16H,14H2,1-2H3,(H,27,30)