5-[[(2-chlorophenyl)amino]methyl]-2-methylsulfanyl-pyrimidin-4-amine

Systemtic Name: 5-[[(2-chlorophenyl)amino]methyl]-2-methylsulfanyl-pyrimidin-4-amine Openeye Name: 5-[(2-chloroanilino)methyl]-2-methylsulfanyl-pyrimidin-4-amine CAS Name: 5-[(2-chloroanilino)methyl]-2-(methylthio)-4-pyrimidinamine IUPAC Name: 5-[(2-chloroanilino)methyl]-2-methylsulfanylpyrimidin-4-amine Traditional Name: [4-amino-2-(methylthio)pyrimidin-5-yl]methyl-(2-chlorophenyl)amine Formula: C12H13ClN4S MolecularWeight: 280.77642

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)N)CNC2=CC=CC=C2Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)N)CNC2=CC=CC=C2Cl

InChI

InChI=1S/C12H13ClN4S/c1-18-12-16-7-8(11(14)17-12)6-15-10-5-3-2-4-9(10)13/h2-5,7,15H,6H2,1H3,(H2,14,16,17)