(2S)-2-[3-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-methoxyphenyl)propanamide

Systemtic Name: (2S)-2-[3-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-methoxyphenyl)propanamide Openeye Name: (2S)-2-[3-(3-fluoro-4-methyl-phenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(4-methoxyphenyl)propanamide CAS Name: (2S)-2-[[3-(3-fluoro-4-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(4-methoxyphenyl)propanamide IUPAC Name: (2S)-2-[3-(3-fluoro-4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4-methoxyphenyl)propanamide Traditional Name: (2S)-2-[[3-(3-fluoro-4-methyl-phenyl)-4-keto-quinazolin-2-yl]thio]-N-(4-methoxyphenyl)propionamide Formula: C25H22FN3O3S MolecularWeight: 463.523883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=CC=C(C=C4)OC)F

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2S[C@@H](C)C(=O)NC4=CC=C(C=C4)OC)F

InChI

InChI=1S/C25H22FN3O3S/c1-15-8-11-18(14-21(15)26)29-24(31)20-6-4-5-7-22(20)28-25(29)33-16(2)23(30)27-17-9-12-19(32-3)13-10-17/h4-14,16H,1-3H3,(H,27,30)/t16-/m0/s1