2-[(2-chloranylquinazolin-4-yl)amino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(2-chloranylquinazolin-4-yl)amino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(2-chloroquinazolin-4-yl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[(2-chloro-4-quinazolinyl)amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(2-chloroquinazolin-4-yl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(2-chloroquinazolin-4-yl)amino]-4-(methylthio)butyric acid Formula: C13H14ClN3O2S MolecularWeight: 311.78716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC1=NC(=NC2=CC=CC=C21)Cl

Isomeric SMILES

CSCCC(C(=O)O)NC1=NC(=NC2=CC=CC=C21)Cl

InChI

InChI=1S/C13H14ClN3O2S/c1-20-7-6-10(12(18)19)15-11-8-4-2-3-5-9(8)16-13(14)17-11/h2-5,10H,6-7H2,1H3,(H,18,19)(H,15,16,17)