[2-azanyl-2-methyl-4-[5-[4-(3-methylsulfanylphenoxy)butanoyl]thiophen-2-yl]butyl] dihydrogen phosphate

Systemtic Name: [2-azanyl-2-methyl-4-[5-[4-(3-methylsulfanylphenoxy)butanoyl]thiophen-2-yl]butyl] dihydrogen phosphate Openeye Name: [2-amino-2-methyl-4-[5-[4-(3-methylsulfanylphenoxy)butanoyl]-2-thienyl]butyl] dihydrogen phosphate CAS Name: [2-amino-2-methyl-4-[5-[4-[3-(methylthio)phenoxy]-1-oxobutyl]-2-thiophenyl]butyl] dihydrogen phosphate IUPAC Name: [2-amino-2-methyl-4-[5-[4-(3-methylsulfanylphenoxy)butanoyl]thiophen-2-yl]butyl] dihydrogen phosphate Traditional Name: [2-amino-2-methyl-4-[5-[4-[3-(methylthio)phenoxy]butanoyl]-2-thienyl]butyl] dihydrogen phosphate Formula: C20H28NO6PS2 MolecularWeight: 473.543181

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C(=O)CCCOC2=CC(=CC=C2)SC)(COP(=O)(O)O)N

Isomeric SMILES

CC(CCC1=CC=C(S1)C(=O)CCCOC2=CC(=CC=C2)SC)(COP(=O)(O)O)N

InChI

InChI=1S/C20H28NO6PS2/c1-20(21,14-27-28(23,24)25)11-10-16-8-9-19(30-16)18(22)7-4-12-26-15-5-3-6-17(13-15)29-2/h3,5-6,8-9,13H,4,7,10-12,14,21H2,1-2H3,(H2,23,24,25)