[2-azanyl-4-[5-(5-cyclohexylpent-1-ynyl)thiophen-2-yl]-2-ethyl-butyl] dihydrogen phosphate

Systemtic Name: [2-azanyl-4-[5-(5-cyclohexylpent-1-ynyl)thiophen-2-yl]-2-ethyl-butyl] dihydrogen phosphate Openeye Name: [2-amino-4-[5-(5-cyclohexylpent-1-ynyl)-2-thienyl]-2-ethyl-butyl] dihydrogen phosphate CAS Name: [2-amino-4-[5-(5-cyclohexylpent-1-ynyl)-2-thiophenyl]-2-ethylbutyl] dihydrogen phosphate IUPAC Name: [2-amino-4-[5-(5-cyclohexylpent-1-ynyl)thiophen-2-yl]-2-ethylbutyl] dihydrogen phosphate Traditional Name: [2-amino-4-[5-(5-cyclohexylpent-1-ynyl)-2-thienyl]-2-ethyl-butyl] dihydrogen phosphate Formula: C21H34NO4PS MolecularWeight: 427.537721

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC=C(S1)C#CCCCC2CCCCC2)(COP(=O)(O)O)N

Isomeric SMILES

CCC(CCC1=CC=C(S1)C#CCCCC2CCCCC2)(COP(=O)(O)O)N

InChI

InChI=1S/C21H34NO4PS/c1-2-21(22,17-26-27(23,24)25)16-15-20-14-13-19(28-20)12-8-4-7-11-18-9-5-3-6-10-18/h13-14,18H,2-7,9-11,15-17,22H2,1H3,(H2,23,24,25)