N-[4-[2-(6-fluoranyl-2-phenyl-quinazolin-4-yl)sulfanylethanoylamino]phenyl]propanamide

Systemtic Name: N-[4-[2-(6-fluoranyl-2-phenyl-quinazolin-4-yl)sulfanylethanoylamino]phenyl]propanamide Openeye Name: N-[4-[[2-(6-fluoro-2-phenyl-quinazolin-4-yl)sulfanylacetyl]amino]phenyl]propanamide CAS Name: N-[4-[[2-[(6-fluoro-2-phenyl-4-quinazolinyl)thio]-1-oxoethyl]amino]phenyl]propanamide IUPAC Name: N-[4-[[2-(6-fluoro-2-phenylquinazolin-4-yl)sulfanylacetyl]amino]phenyl]propanamide Traditional Name: N-[4-[[2-[(6-fluoro-2-phenyl-quinazolin-4-yl)thio]acetyl]amino]phenyl]propionamide Formula: C25H21FN4O2S MolecularWeight: 460.523243

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC3=C2C=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC3=C2C=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C25H21FN4O2S/c1-2-22(31)27-18-9-11-19(12-10-18)28-23(32)15-33-25-20-14-17(26)8-13-21(20)29-24(30-25)16-6-4-3-5-7-16/h3-14H,2,15H2,1H3,(H,27,31)(H,28,32)