N-[(4-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylsulfanyl]quinazolin-4-amine

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylsulfanyl]quinazolin-4-amine Openeye Name: N-[(4-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylsulfanyl]quinazolin-4-amine CAS Name: N-[(4-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylthio]-4-quinazolinamine IUPAC Name: N-[(4-chlorophenyl)methyl]-2-[(2-fluorophenyl)methylsulfanyl]quinazolin-4-amine Traditional Name: (4-chlorobenzyl)-[2-[(2-fluorobenzyl)thio]quinazolin-4-yl]amine Formula: C22H17ClFN3S MolecularWeight: 409.906883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3C(=N2)NCC4=CC=C(C=C4)Cl)F

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3C(=N2)NCC4=CC=C(C=C4)Cl)F

InChI

InChI=1S/C22H17ClFN3S/c23-17-11-9-15(10-12-17)13-25-21-18-6-2-4-8-20(18)26-22(27-21)28-14-16-5-1-3-7-19(16)24/h1-12H,13-14H2,(H,25,26,27)