2-[1-(2-chlorophenyl)ethylsulfanyl]pyrimidine-4,6-diamine

Systemtic Name: 2-[1-(2-chlorophenyl)ethylsulfanyl]pyrimidine-4,6-diamine Openeye Name: 2-[1-(2-chlorophenyl)ethylsulfanyl]pyrimidine-4,6-diamine CAS Name: 2-[1-(2-chlorophenyl)ethylthio]pyrimidine-4,6-diamine IUPAC Name: 2-[1-(2-chlorophenyl)ethylsulfanyl]pyrimidine-4,6-diamine Traditional Name: [6-amino-2-[1-(2-chlorophenyl)ethylthio]pyrimidin-4-yl]amine Formula: C12H13ClN4S MolecularWeight: 280.77642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)SC2=NC(=CC(=N2)N)N

Isomeric SMILES

CC(C1=CC=CC=C1Cl)SC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C12H13ClN4S/c1-7(8-4-2-3-5-9(8)13)18-12-16-10(14)6-11(15)17-12/h2-7H,1H3,(H4,14,15,16,17)