5-[[[2,6-bis(chloranyl)phenyl]amino]methyl]-2-methylsulfanyl-N-phenyl-pyrimidin-4-amine

Systemtic Name: 5-[[[2,6-bis(chloranyl)phenyl]amino]methyl]-2-methylsulfanyl-N-phenyl-pyrimidin-4-amine Openeye Name: 5-[(2,6-dichloroanilino)methyl]-2-methylsulfanyl-N-phenyl-pyrimidin-4-amine CAS Name: 5-[(2,6-dichloroanilino)methyl]-2-(methylthio)-N-phenyl-4-pyrimidinamine IUPAC Name: 5-[(2,6-dichloroanilino)methyl]-2-methylsulfanyl-N-phenylpyrimidin-4-amine Traditional Name: [4-anilino-2-(methylthio)pyrimidin-5-yl]methyl-(2,6-dichlorophenyl)amine Formula: C18H16Cl2N4S MolecularWeight: 391.31744

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)NC2=CC=CC=C2)CNC3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)NC2=CC=CC=C2)CNC3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C18H16Cl2N4S/c1-25-18-22-11-12(10-21-16-14(19)8-5-9-15(16)20)17(24-18)23-13-6-3-2-4-7-13/h2-9,11,21H,10H2,1H3,(H,22,23,24)