2-[[2-(4-ethylphenyl)-2-(3-methylsulfanylpiperazin-1-yl)ethyl]amino]phenol

Systemtic Name: 2-[[2-(4-ethylphenyl)-2-(3-methylsulfanylpiperazin-1-yl)ethyl]amino]phenol Openeye Name: 2-[[2-(4-ethylphenyl)-2-(3-methylsulfanylpiperazin-1-yl)ethyl]amino]phenol CAS Name: 2-[[2-(4-ethylphenyl)-2-[3-(methylthio)-1-piperazinyl]ethyl]amino]phenol IUPAC Name: 2-[[2-(4-ethylphenyl)-2-(3-methylsulfanylpiperazin-1-yl)ethyl]amino]phenol Traditional Name: 2-[[2-(4-ethylphenyl)-2-[3-(methylthio)piperazino]ethyl]amino]phenol Formula: C21H29N3OS MolecularWeight: 371.53946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CNC2=CC=CC=C2O)N3CCNC(C3)SC

Isomeric SMILES

CCC1=CC=C(C=C1)C(CNC2=CC=CC=C2O)N3CCNC(C3)SC

InChI

InChI=1S/C21H29N3OS/c1-3-16-8-10-17(11-9-16)19(24-13-12-22-21(15-24)26-2)14-23-18-6-4-5-7-20(18)25/h4-11,19,21-23,25H,3,12-15H2,1-2H3