N-[(4-fluorophenyl)methyl]-3-[2-[(2-methylphenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]propanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-3-[2-[(2-methylphenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]propanamide Openeye Name: N-[(4-fluorophenyl)methyl]-3-[2-(o-tolylmethylsulfanyl)-4-oxo-quinazolin-3-yl]propanamide CAS Name: N-[(4-fluorophenyl)methyl]-3-[2-[(2-methylphenyl)methylthio]-4-oxo-3-quinazolinyl]propanamide IUPAC Name: N-[(4-fluorophenyl)methyl]-3-[2-[(2-methylphenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]propanamide Traditional Name: N-(4-fluorobenzyl)-3-[4-keto-2-[(2-methylbenzyl)thio]quinazolin-3-yl]propionamide Formula: C26H24FN3O2S MolecularWeight: 461.551063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC3=CC=CC=C3C(=O)N2CCC(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC3=CC=CC=C3C(=O)N2CCC(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C26H24FN3O2S/c1-18-6-2-3-7-20(18)17-33-26-29-23-9-5-4-8-22(23)25(32)30(26)15-14-24(31)28-16-19-10-12-21(27)13-11-19/h2-13H,14-17H2,1H3,(H,28,31)