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

Systemtic Name: [2-azanyl-2-methyl-4-[5-[3-(4-methylsulfanylphenoxy)prop-1-ynyl]thiophen-2-yl]butyl] dihydrogen phosphate Openeye Name: [2-amino-2-methyl-4-[5-[3-(4-methylsulfanylphenoxy)prop-1-ynyl]-2-thienyl]butyl] dihydrogen phosphate CAS Name: [2-amino-2-methyl-4-[5-[3-[4-(methylthio)phenoxy]prop-1-ynyl]-2-thiophenyl]butyl] dihydrogen phosphate IUPAC Name: [2-amino-2-methyl-4-[5-[3-(4-methylsulfanylphenoxy)prop-1-ynyl]thiophen-2-yl]butyl] dihydrogen phosphate Traditional Name: [2-amino-2-methyl-4-[5-[3-[4-(methylthio)phenoxy]prop-1-ynyl]-2-thienyl]butyl] dihydrogen phosphate Formula: C19H24NO5PS2 MolecularWeight: 441.501321

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C#CCOC2=CC=C(C=C2)SC)(COP(=O)(O)O)N

Isomeric SMILES

CC(CCC1=CC=C(S1)C#CCOC2=CC=C(C=C2)SC)(COP(=O)(O)O)N

InChI

InChI=1S/C19H24NO5PS2/c1-19(20,14-25-26(21,22)23)12-11-18-10-9-17(28-18)4-3-13-24-15-5-7-16(27-2)8-6-15/h5-10H,11-14,20H2,1-2H3,(H2,21,22,23)