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3-methoxy-4-[3-[3-(piperidin-1-ylmethylsulfanyl)phenoxy]propylamino]cyclobut-3-ene-1,2-dione

3-methoxy-4-[3-[3-(piperidin-1-ylmethylsulfanyl)phenoxy]propylamino]cyclobut-3-ene-1,2-dione

Systemtic Name:3-methoxy-4-[3-[3-(piperidin-1-ylmethylsulfanyl)phenoxy]propylamino]cyclobut-3-ene-1,2-dione
Openeye Name:3-methoxy-4-[3-[3-(1-piperidylmethylsulfanyl)phenoxy]propylamino]cyclobut-3-ene-1,2-dione
CAS Name:3-methoxy-4-[3-[3-(1-piperidinylmethylthio)phenoxy]propylamino]cyclobut-3-ene-1,2-dione
IUPAC Name:3-methoxy-4-[3-[3-(piperidin-1-ylmethylsulfanyl)phenoxy]propylamino]cyclobut-3-ene-1,2-dione
Traditional Name:3-methoxy-4-[3-[3-(piperidinomethylthio)phenoxy]propylamino]cyclobut-3-ene-1,2-quinone
Formula: C20H26N2O4S
MolecularWeight: 390.49644
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)C1=O)NCCCOC2=CC(=CC=C2)SCN3CCCCC3


Isomeric SMILES

COC1=C(C(=O)C1=O)NCCCOC2=CC(=CC=C2)SCN3CCCCC3


InChI

InChI=1S/C20H26N2O4S/c1-25-20-17(18(23)19(20)24)21-9-6-12-26-15-7-5-8-16(13-15)27-14-22-10-3-2-4-11-22/h5,7-8,13,21H,2-4,6,9-12,14H2,1H3


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