[2-azanyl-2-methyl-4-[5-[4-(3-methylsulfanylphenoxy)but-1-ynyl]thiophen-2-yl]butyl] dihydrogen phosphate

Systemtic Name: [2-azanyl-2-methyl-4-[5-[4-(3-methylsulfanylphenoxy)but-1-ynyl]thiophen-2-yl]butyl] dihydrogen phosphate Openeye Name: [2-amino-2-methyl-4-[5-[4-(3-methylsulfanylphenoxy)but-1-ynyl]-2-thienyl]butyl] dihydrogen phosphate CAS Name: [2-amino-2-methyl-4-[5-[4-[3-(methylthio)phenoxy]but-1-ynyl]-2-thiophenyl]butyl] dihydrogen phosphate IUPAC Name: [2-amino-2-methyl-4-[5-[4-(3-methylsulfanylphenoxy)but-1-ynyl]thiophen-2-yl]butyl] dihydrogen phosphate Traditional Name: [2-amino-2-methyl-4-[5-[4-[3-(methylthio)phenoxy]but-1-ynyl]-2-thienyl]butyl] dihydrogen phosphate Formula: C20H26NO5PS2 MolecularWeight: 455.527901

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26NO5PS2/c1-20(21,15-26-27(22,23)24)12-11-18-10-9-17(29-18)7-3-4-13-25-16-6-5-8-19(14-16)28-2/h5-6,8-10,14H,4,11-13,15,21H2,1-2H3,(H2,22,23,24)