N-[2-(4-chlorophenyl)sulfanylethyl]pyrimidin-2-amine

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylethyl]pyrimidin-2-amine Openeye Name: N-[2-(4-chlorophenyl)sulfanylethyl]pyrimidin-2-amine CAS Name: N-[2-[(4-chlorophenyl)thio]ethyl]-2-pyrimidinamine IUPAC Name: N-[2-(4-chlorophenyl)sulfanylethyl]pyrimidin-2-amine Traditional Name: 2-[(4-chlorophenyl)thio]ethyl-(2-pyrimidyl)amine Formula: C12H12ClN3S MolecularWeight: 265.76178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CN=C(N=C1)NCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H12ClN3S/c13-10-2-4-11(5-3-10)17-9-8-16-12-14-6-1-7-15-12/h1-7H,8-9H2,(H,14,15,16)