N4-[3,5-bis(chloranyl)-4-pyridin-4-ylsulfanyl-phenyl]-6-methyl-pyrimidine-2,4-diamine

Systemtic Name: N4-[3,5-bis(chloranyl)-4-pyridin-4-ylsulfanyl-phenyl]-6-methyl-pyrimidine-2,4-diamine Openeye Name: N4-[3,5-dichloro-4-(4-pyridylsulfanyl)phenyl]-6-methyl-pyrimidine-2,4-diamine CAS Name: N4-[3,5-dichloro-4-(pyridin-4-ylthio)phenyl]-6-methylpyrimidine-2,4-diamine IUPAC Name: 4-N-(3,5-dichloro-4-pyridin-4-ylsulfanylphenyl)-6-methylpyrimidine-2,4-diamine Traditional Name: (2-amino-6-methyl-pyrimidin-4-yl)-[3,5-dichloro-4-(4-pyridylthio)phenyl]amine Formula: C16H13Cl2N5S MolecularWeight: 378.27892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N)NC2=CC(=C(C(=C2)Cl)SC3=CC=NC=C3)Cl

Isomeric SMILES

CC1=CC(=NC(=N1)N)NC2=CC(=C(C(=C2)Cl)SC3=CC=NC=C3)Cl

InChI

InChI=1S/C16H13Cl2N5S/c1-9-6-14(23-16(19)21-9)22-10-7-12(17)15(13(18)8-10)24-11-2-4-20-5-3-11/h2-8H,1H3,(H3,19,21,22,23)