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

Systemtic Name: [2-azanyl-2-methyl-4-[5-[4-(4-methylsulfanylphenyl)but-1-ynyl]thiophen-2-yl]butyl] dihydrogen phosphate Openeye Name: [2-amino-2-methyl-4-[5-[4-(4-methylsulfanylphenyl)but-1-ynyl]-2-thienyl]butyl] dihydrogen phosphate CAS Name: [2-amino-2-methyl-4-[5-[4-[4-(methylthio)phenyl]but-1-ynyl]-2-thiophenyl]butyl] dihydrogen phosphate IUPAC Name: [2-amino-2-methyl-4-[5-[4-(4-methylsulfanylphenyl)but-1-ynyl]thiophen-2-yl]butyl] dihydrogen phosphate Traditional Name: [2-amino-2-methyl-4-[5-[4-[4-(methylthio)phenyl]but-1-ynyl]-2-thienyl]butyl] dihydrogen phosphate Formula: C20H26NO4PS2 MolecularWeight: 439.528501

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C#CCCC2=CC=C(C=C2)SC)(COP(=O)(O)O)N

Isomeric SMILES

CC(CCC1=CC=C(S1)C#CCCC2=CC=C(C=C2)SC)(COP(=O)(O)O)N

InChI

InChI=1S/C20H26NO4PS2/c1-20(21,15-25-26(22,23)24)14-13-19-12-11-18(28-19)6-4-3-5-16-7-9-17(27-2)10-8-16/h7-12H,3,5,13-15,21H2,1-2H3,(H2,22,23,24)