[(2S)-2-azanyl-2-methyl-3-oxidanylidene-3-[[4-(4-thiophen-2-ylbutoxy)phenyl]amino]propyl] dihydrogen phosphate

Systemtic Name: [(2S)-2-azanyl-2-methyl-3-oxidanylidene-3-[[4-(4-thiophen-2-ylbutoxy)phenyl]amino]propyl] dihydrogen phosphate Openeye Name: [(2S)-2-amino-2-methyl-3-oxo-3-[4-[4-(2-thienyl)butoxy]anilino]propyl] dihydrogen phosphate CAS Name: [(2S)-2-amino-2-methyl-3-oxo-3-[4-(4-thiophen-2-ylbutoxy)anilino]propyl] dihydrogen phosphate IUPAC Name: [(2S)-2-amino-2-methyl-3-oxo-3-[4-(4-thiophen-2-ylbutoxy)anilino]propyl] dihydrogen phosphate Traditional Name: [(2S)-2-amino-3-keto-2-methyl-3-[4-[4-(2-thienyl)butoxy]anilino]propyl] dihydrogen phosphate Formula: C18H25N2O6PS MolecularWeight: 428.439661

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Descriptors Computed from Structure

Canonical SMILES:

CC(COP(=O)(O)O)(C(=O)NC1=CC=C(C=C1)OCCCCC2=CC=CS2)N

Isomeric SMILES

C[C@](COP(=O)(O)O)(C(=O)NC1=CC=C(C=C1)OCCCCC2=CC=CS2)N

InChI

InChI=1S/C18H25N2O6PS/c1-18(19,13-26-27(22,23)24)17(21)20-14-7-9-15(10-8-14)25-11-3-2-5-16-6-4-12-28-16/h4,6-10,12H,2-3,5,11,13,19H2,1H3,(H,20,21)(H2,22,23,24)/t18-/m0/s1