[2-[4-[(5-ethyl-2-methoxy-6-methyl-pyridin-3-yl)amino]piperazin-1-yl]phenyl]sulfanyl-methylsulfanyl-methanone

Systemtic Name: [2-[4-[(5-ethyl-2-methoxy-6-methyl-pyridin-3-yl)amino]piperazin-1-yl]phenyl]sulfanyl-methylsulfanyl-methanone Openeye Name: [2-[4-[(5-ethyl-2-methoxy-6-methyl-3-pyridyl)amino]piperazin-1-yl]phenyl]sulfanyl-methylsulfanyl-methanone CAS Name: [[2-[4-[(5-ethyl-2-methoxy-6-methyl-3-pyridinyl)amino]-1-piperazinyl]phenyl]thio]-(methylthio)methanone IUPAC Name: [2-[4-[(5-ethyl-2-methoxy-6-methylpyridin-3-yl)amino]piperazin-1-yl]phenyl]sulfanyl-methylsulfanylmethanone Traditional Name: [[2-[4-[(5-ethyl-2-methoxy-6-methyl-3-pyridyl)amino]piperazino]phenyl]thio]-(methylthio)methanone Formula: C21H28N4O2S2 MolecularWeight: 432.60262

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(N=C1C)OC)NN2CCN(CC2)C3=CC=CC=C3SC(=O)SC

Isomeric SMILES

CCC1=CC(=C(N=C1C)OC)NN2CCN(CC2)C3=CC=CC=C3SC(=O)SC

InChI

InChI=1S/C21H28N4O2S2/c1-5-16-14-17(20(27-3)22-15(16)2)23-25-12-10-24(11-13-25)18-8-6-7-9-19(18)29-21(26)28-4/h6-9,14,23H,5,10-13H2,1-4H3