5-methyl-2-(2-piperazin-1-ylethyl)benzenethiol

Systemtic Name: 5-methyl-2-(2-piperazin-1-ylethyl)benzenethiol Openeye Name: 5-methyl-2-(2-piperazin-1-ylethyl)benzenethiol CAS Name: 5-methyl-2-[2-(1-piperazinyl)ethyl]benzenethiol IUPAC Name: 5-methyl-2-(2-piperazin-1-ylethyl)benzenethiol Traditional Name: 5-methyl-2-(2-piperazinoethyl)benzenethiol Formula: C13H20N2S MolecularWeight: 236.3763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CCN2CCNCC2)S

Isomeric SMILES

CC1=CC(=C(C=C1)CCN2CCNCC2)S

InChI

InChI=1S/C13H20N2S/c1-11-2-3-12(13(16)10-11)4-7-15-8-5-14-6-9-15/h2-3,10,14,16H,4-9H2,1H3