2-[(3-chloranyl-4-fluoranyl-phenyl)sulfanylmethyl]quinazolin-4-amine

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)sulfanylmethyl]quinazolin-4-amine Openeye Name: 2-[(3-chloro-4-fluoro-phenyl)sulfanylmethyl]quinazolin-4-amine CAS Name: 2-[[(3-chloro-4-fluorophenyl)thio]methyl]-4-quinazolinamine IUPAC Name: 2-[(3-chloro-4-fluorophenyl)sulfanylmethyl]quinazolin-4-amine Traditional Name: [2-[[(3-chloro-4-fluoro-phenyl)thio]methyl]quinazolin-4-yl]amine Formula: C15H11ClFN3S MolecularWeight: 319.784343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)CSC3=CC(=C(C=C3)F)Cl)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)CSC3=CC(=C(C=C3)F)Cl)N

InChI

InChI=1S/C15H11ClFN3S/c16-11-7-9(5-6-12(11)17)21-8-14-19-13-4-2-1-3-10(13)15(18)20-14/h1-7H,8H2,(H2,18,19,20)