4-(3-methylsulfanylpiperazin-1-yl)-3-propyl-phenol

Systemtic Name: 4-(3-methylsulfanylpiperazin-1-yl)-3-propyl-phenol Openeye Name: 4-(3-methylsulfanylpiperazin-1-yl)-3-propyl-phenol CAS Name: 4-[3-(methylthio)-1-piperazinyl]-3-propylphenol IUPAC Name: 4-(3-methylsulfanylpiperazin-1-yl)-3-propylphenol Traditional Name: 4-[3-(methylthio)piperazino]-3-propyl-phenol Formula: C14H22N2OS MolecularWeight: 266.40228

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)O)N2CCNC(C2)SC

Isomeric SMILES

CCCC1=C(C=CC(=C1)O)N2CCNC(C2)SC

InChI

InChI=1S/C14H22N2OS/c1-3-4-11-9-12(17)5-6-13(11)16-8-7-15-14(10-16)18-2/h5-6,9,14-15,17H,3-4,7-8,10H2,1-2H3