3-iodanyl-1-(2-methyl-4-methylsulfanyl-phenyl)piperazine

Systemtic Name: 3-iodanyl-1-(2-methyl-4-methylsulfanyl-phenyl)piperazine Openeye Name: 3-iodo-1-(2-methyl-4-methylsulfanyl-phenyl)piperazine CAS Name: 3-iodo-1-[2-methyl-4-(methylthio)phenyl]piperazine IUPAC Name: 3-iodo-1-(2-methyl-4-methylsulfanylphenyl)piperazine Traditional Name: 3-iodo-1-[2-methyl-4-(methylthio)phenyl]piperazine Formula: C12H17IN2S MolecularWeight: 348.24625

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC)N2CCNC(C2)I

Isomeric SMILES

CC1=C(C=CC(=C1)SC)N2CCNC(C2)I

InChI

InChI=1S/C12H17IN2S/c1-9-7-10(16-2)3-4-11(9)15-6-5-14-12(13)8-15/h3-4,7,12,14H,5-6,8H2,1-2H3