2-[(4-fluorophenyl)methylsulfanyl]-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(4-fluorophenyl)methylsulfanyl]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide CAS Name: 2-[(4-fluorophenyl)methylthio]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(4-fluorophenyl)methylsulfanyl]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide Traditional Name: N-benzyl-2-[(4-fluorobenzyl)thio]-N-[(4-keto-1H-quinazolin-2-yl)methyl]acetamide Formula: C25H22FN3O2S MolecularWeight: 447.524483

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=NC(=O)C3=CC=CC=C3N2)C(=O)CSCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=NC(=O)C3=CC=CC=C3N2)C(=O)CSCC4=CC=C(C=C4)F

InChI

InChI=1S/C25H22FN3O2S/c26-20-12-10-19(11-13-20)16-32-17-24(30)29(14-18-6-2-1-3-7-18)15-23-27-22-9-5-4-8-21(22)25(31)28-23/h1-13H,14-17H2,(H,27,28,31)